data_2jxx_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 2jxx _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 . . . . . 0 N--CA 1.474 0.742 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.533 HD11 ' HB2' ' A' ' 82' ' ' PRO . 71.4 mt -106.03 126.67 52.47 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.599 1.16 . . . . 0.0 109.072 -177.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -88.53 102.16 14.65 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 54.6 mt -109.04 129.4 55.46 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.851 0.861 . . . . 0.0 109.581 -171.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.631 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 58.9 mtt180 -87.64 105.86 17.63 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -99.76 114.22 37.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -137.05 145.51 44.11 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.564 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.339 0.73 0 O-C-N 123.423 0.452 . . . . 0.0 113.588 -173.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 91.3 m . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.1 tp -143.24 153.58 42.96 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.002 0.365 . . . . 0.0 110.218 169.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.631 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 12.4 pt-20 -133.78 133.97 42.34 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 164.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -142.05 153.98 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 123.61 0.764 . . . . 0.0 109.785 -174.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.6 m -93.26 107.28 19.13 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.405 ' HB2' HD11 ' A' ' 52' ' ' LEU . 26.6 tp -95.13 128.86 42.3 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.1 t -72.48 141.44 48.57 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.42 -28.53 69.86 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.18 0.592 . . . . 0.0 112.156 -171.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -91.09 -18.09 25.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.909 0.884 . . . . 0.0 111.524 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -94.05 129.11 38.58 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 123.525 0.73 . . . . 0.0 109.44 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.468 ' O ' HG21 ' A' ' 51' ' ' THR . 8.4 Cg_endo -67.12 161.98 40.37 Favored 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.583 2.188 . . . . 0.0 114.174 -175.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.45 -30.32 40.1 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 125.496 1.519 . . . . 0.0 112.207 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -38.39 72.84 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.468 HG21 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -69.37 -28.68 66.41 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.883 179.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 43' ' ' LEU . 4.6 tt -74.37 -39.08 62.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.143 0.977 . . . . 0.0 110.268 172.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.479 ' HE3' ' HB2' ' A' ' 69' ' ' PHE . 64.3 mtt -60.54 -42.37 96.4 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.992 0.917 . . . . 0.0 111.213 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 p -71.27 -37.27 71.9 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -65.23 -48.81 71.99 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.132 0.573 . . . . 0.0 110.429 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -53.15 -57.46 10.39 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.58 1.552 . . . . 0.0 112.235 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -60.04 -41.19 91.73 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.779 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.83 -40.58 95.78 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.149 0 C-N-CA 123.632 0.773 . . . . 0.0 112.589 -179.789 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.414 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -78.59 155.37 29.66 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.431 0.692 . . . . 0.0 111.691 -177.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.479 ' HB2' ' HE3' ' A' ' 53' ' ' MET . 44.9 m-85 -131.58 130.89 42.81 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.165 0.986 . . . . 0.0 109.582 -178.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -128.53 146.66 50.77 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.288 1.035 . . . . 0.0 110.756 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.554 ' HB3' HD21 ' A' ' 76' ' ' LEU . 11.7 t80 -142.93 119.69 11.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.638 1.175 . . . . 0.0 108.565 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.0 t70 57.2 32.64 22.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.325 1.05 . . . . 0.0 111.042 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.13 -17.38 28.18 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.441 -0.799 . . . . 0.0 113.655 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 63.4 m -73.37 123.8 24.51 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 123.902 0.881 . . . . 0.0 110.572 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -70.32 114.24 8.26 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.554 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.7 mt -81.1 112.88 18.87 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 176.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.5 t -76.36 -21.77 55.68 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.55 0.74 . . . . 0.0 110.969 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.05 -31.84 6.07 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.49 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -91.75 9.73 31.35 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.09 0.956 . . . . 0.0 111.959 -172.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.425 ' HG3' HD23 ' A' ' 85' ' ' LEU . 2.0 pm0 -93.92 148.64 21.95 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 166.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 mt -94.69 155.83 38.98 Favored Pre-proline 0 C--N 1.314 -0.972 0 C-N-CA 125.213 1.405 . . . . 0.0 108.36 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.533 ' HB2' HD11 ' A' ' 26' ' ' LEU . 63.1 Cg_endo -67.18 -36.14 22.48 Favored 'Trans proline' 0 C--N 1.368 1.603 0 C-N-CA 121.575 1.516 . . . . 0.0 111.089 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -27.51 66.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.477 0.711 . . . . 0.0 111.184 174.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.05 -43.43 71.25 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.635 0.774 . . . . 0.0 110.844 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.425 HD23 ' HG3' ' A' ' 80' ' ' GLU . 83.9 mt -71.88 -21.46 61.65 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.732 0.813 . . . . 0.0 111.211 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.21 42.6 7.43 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 111.768 -0.533 . . . . 0.0 111.768 -178.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.403 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 73.9 mtp -95.55 165.11 12.5 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.92 0.888 . . . . 0.0 110.539 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.7 tp10 -147.8 162.46 39.17 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.409 0.684 . . . . 0.0 109.734 -177.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 p -59.64 119.87 8.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.718 0.807 . . . . 0.0 110.996 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.19 36.07 4.8 Favored Glycine 0 C--N 1.341 0.861 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.43 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t0 -98.38 -172.08 2.26 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.8 tp -142.43 109.91 5.71 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.7 mt -94.41 148.5 4.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 167.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -119.72 156.82 29.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.564 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 39.5 t -137.76 136.93 45.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -175.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 80.5 m95 . . . . . 0 N--CA 1.466 0.371 0 C-N-CA 123.998 0.919 . . . . 0.0 108.829 -175.403 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 . . . . . 0 C--O 1.24 0.565 0 CA-C-O 122.17 0.986 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 7.8 mp -98.79 109.15 21.95 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.131 -176.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -81.49 102.91 10.86 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.472 HD21 ' HB2' ' A' ' 91' ' ' ASP . 39.8 mt -108.7 135.84 49.27 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -174.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -91.84 130.02 37.69 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -121.89 117.84 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -132.1 139.44 48.48 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -172.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.433 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.34 0.779 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.2 tp -131.88 154.32 49.32 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.008 0.923 . . . . 0.0 108.634 176.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -132.49 134.11 44.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 162.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.68 149.76 33.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 124.194 0.998 . . . . 0.0 109.637 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.5 m -91.78 108.34 19.85 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.1 tp -96.32 131.13 43.16 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.04 0.936 . . . . 0.0 109.611 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.3 m -78.81 138.11 38.03 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.7 ptm180 -63.21 -23.83 67.6 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -175.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.08 -18.71 31.65 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.87 0.468 . . . . 0.0 110.533 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -92.28 134.19 28.74 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.168 0.987 . . . . 0.0 109.764 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.458 ' O ' HG21 ' A' ' 51' ' ' THR . 1.2 Cg_endo -70.43 164.92 33.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.558 2.172 . . . . 0.0 113.06 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -58.58 -24.63 61.26 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 111.921 178.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -34.61 71.56 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.453 0.701 . . . . 0.0 111.981 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.458 HG21 ' O ' ' A' ' 48' ' ' PRO . 7.4 t -74.47 -31.85 62.38 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-O 120.812 0.339 . . . . 0.0 110.548 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -67.26 -42.11 84.45 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.547 1.139 . . . . 0.0 110.181 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 61.8 mtt -57.65 -47.24 82.8 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.12 0.968 . . . . 0.0 110.476 172.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 m -65.01 -30.47 71.46 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.679 1.237 . . . . 0.0 110.062 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -70.66 -56.6 6.08 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.79 -60.99 2.67 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.684 1.194 . . . . 0.0 112.521 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.3 pt-20 -60.71 -36.81 79.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -74.35 -34.76 63.48 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.115 0 C-N-CA 123.528 0.731 . . . . 0.0 111.011 -176.363 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.3 m -82.1 148.58 28.47 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.409 0.683 . . . . 0.0 109.665 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.448 ' HB3' HD22 ' A' ' 76' ' ' LEU . 45.1 m-85 -122.82 128.85 50.96 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -129.83 127.54 40.48 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.142 0.496 . . . . 0.0 111.714 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -122.45 106.95 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 107.86 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.2 t70 49.32 47.92 21.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.583 1.153 . . . . 0.0 111.485 -174.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 82.37 -22.34 6.37 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 114.778 -1.101 . . . . 0.0 114.212 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 m -71.21 111.92 6.93 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.324 0.65 . . . . 0.0 110.097 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -68.87 114.13 6.92 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.448 HD22 ' HB3' ' A' ' 69' ' ' PHE . 1.1 mm? -75.27 108.22 7.89 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 176.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.5 m -72.52 -29.18 63.37 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.13 0.972 . . . . 0.0 111.839 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.91 -58.13 0.58 Allowed Glycine 0 C--N 1.345 1.068 0 CA-C-N 116.687 -0.233 . . . . 0.0 113.116 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -88.74 10.58 20.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.737 0.815 . . . . 0.0 112.894 -166.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.533 ' HG3' HD23 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -86.35 149.1 25.27 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 170.403 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.5 mt -98.43 151.47 37.49 Favored Pre-proline 0 C--N 1.314 -0.976 0 C-N-CA 125.13 1.372 . . . . 0.0 108.975 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.546 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 40.0 Cg_endo -64.71 -36.1 43.0 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 121.829 1.686 . . . . 0.0 111.498 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.19 81.93 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.427 0.691 . . . . 0.0 111.151 173.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.49 -34.24 76.73 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.877 0.871 . . . . 0.0 111.322 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.533 HD23 ' HG3' ' A' ' 80' ' ' GLU . 56.6 mt -80.77 -23.4 39.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.726 0.811 . . . . 0.0 111.79 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.45 22.85 25.63 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.7 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.478 ' HE3' HD11 ' A' ' 49' ' ' LEU . 52.7 mtt -74.28 168.95 18.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.169 0.988 . . . . 0.0 111.093 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -154.57 174.04 15.49 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 28.5 p -62.61 13.97 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.66 63.68 0.3 Allowed Glycine 0 C--N 1.347 1.145 0 CA-C-N 118.61 0.641 . . . . 0.0 111.614 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.472 ' HB2' HD21 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -110.58 -171.73 1.89 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.601 0.76 . . . . 0.0 110.318 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.0 tp -139.46 144.63 38.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.414 0.686 . . . . 0.0 109.435 -173.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.1 mt -134.09 136.23 53.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -125.12 100.97 6.8 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -170.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.433 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 34.0 t -71.66 128.54 34.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.788 174.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.7 m95 . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 169.544 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.648 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.547 0 CA-C-O 121.726 0.774 . . . . 0.0 112.641 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 mt -109.57 145.6 36.09 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 125.959 1.704 . . . . 0.0 108.742 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -83.01 98.42 9.25 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 175.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.0 mt -107.75 121.89 45.63 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.433 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 82.6 mtt85 -88.87 133.75 34.18 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -125.75 129.69 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -133.38 144.36 49.53 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.036 0.534 . . . . 0.0 110.08 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.576 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.345 1.052 0 O-C-N 123.654 0.596 . . . . 0.0 112.685 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -140.0 131.26 26.62 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.543 1.137 . . . . 0.0 108.042 -178.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.433 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.8 pt-20 -119.01 125.15 48.7 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.63 153.87 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.56 -171.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 m -91.42 108.68 20.06 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.452 HD22 HD22 ' A' ' 49' ' ' LEU . 23.1 tp -107.1 124.75 50.13 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 122.872 0.469 . . . . 0.0 109.746 175.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.648 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 43.1 m -72.52 134.99 45.54 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.601 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.0 ptm180 -73.55 -11.32 60.4 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -171.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -92.45 -17.58 24.37 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.865 0.866 . . . . 0.0 110.325 171.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -94.18 143.88 27.12 Favored Pre-proline 0 C--N 1.354 0.761 0 C-N-CA 124.013 0.925 . . . . 0.0 109.701 -178.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.468 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -72.81 160.57 45.86 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.706 2.271 . . . . 0.0 112.928 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.505 HD12 ' HE1' ' A' ' 87' ' ' MET . 3.1 mm? -56.64 -23.94 44.84 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.399 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -37.55 73.77 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.468 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -71.0 -27.88 64.02 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.008 0.433 . . . . 0.0 110.911 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -74.0 -41.18 62.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.945 0.898 . . . . 0.0 110.286 172.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -55.35 -44.28 75.81 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.057 0.943 . . . . 0.0 110.781 176.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -72.26 -35.97 68.92 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.443 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -70.22 -48.11 58.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.263 0.625 . . . . 0.0 110.537 -175.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.3 -58.85 6.03 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.349 1.06 . . . . 0.0 111.621 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -58.59 -28.71 65.84 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.913 0.758 . . . . 0.0 112.409 -177.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.56 -40.65 63.78 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -172.954 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 120.801 0.334 . . . . 0.0 110.374 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.438 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 16.4 m -84.47 161.12 20.4 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.514 0.726 . . . . 0.0 110.623 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 32.0 m-85 -128.13 127.54 43.21 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.012 0.925 . . . . 0.0 109.156 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -123.08 137.13 55.01 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.77 0.828 . . . . 0.0 110.764 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.521 ' HB3' HD21 ' A' ' 76' ' ' LEU . 28.2 t80 -116.79 110.52 18.51 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.731 1.212 . . . . 0.0 108.318 174.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.1 t70 52.5 39.06 27.16 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-O 121.815 0.817 . . . . 0.0 111.019 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 71.52 22.52 78.62 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 114.91 -1.041 . . . . 0.0 114.656 -177.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.3 m -102.98 120.44 40.64 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.085 0.954 . . . . 0.0 109.128 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.0 114.99 6.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.91 0.484 . . . . 0.0 110.229 177.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.521 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.2 mt -84.6 120.89 26.88 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 27.4 m -77.13 -35.47 56.19 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.777 0.831 . . . . 0.0 112.509 -175.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.73 7.02 13.85 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 123.291 0.472 . . . . 0.0 113.49 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -127.59 10.89 6.71 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 124.036 0.934 . . . . 0.0 110.763 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.414 ' HG3' HD22 ' A' ' 85' ' ' LEU . 1.2 pm0 -105.08 147.84 27.45 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 174.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.99 154.17 37.45 Favored Pre-proline 0 C--N 1.311 -1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 108.579 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.601 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 44.7 Cg_endo -65.43 -29.35 53.69 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.749 1.632 . . . . 0.0 111.187 177.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.17 93.68 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.202 0.601 . . . . 0.0 110.596 172.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.03 -38.23 82.28 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.895 0.878 . . . . 0.0 111.909 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.414 HD22 ' HG3' ' A' ' 80' ' ' GLU . 70.2 mt -77.14 -24.77 51.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.649 0.779 . . . . 0.0 111.437 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.34 24.86 20.6 Favored Glycine 0 C--N 1.348 1.202 0 C-N-CA 122.036 -0.126 . . . . 0.0 113.035 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.505 ' HE1' HD12 ' A' ' 49' ' ' LEU . 63.1 mtt -74.76 170.63 15.48 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.304 1.041 . . . . 0.0 110.798 171.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -155.61 174.7 14.91 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 15.04 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -172.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.66 55.59 0.42 Allowed Glycine 0 C--N 1.342 0.903 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -106.97 -173.2 2.24 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.7 tp -140.02 134.74 31.84 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 121.72 0.771 . . . . 0.0 110.064 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.9 mt -127.94 151.95 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.558 1.543 . . . . 0.0 108.549 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -116.78 165.04 13.76 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.504 1.121 . . . . 0.0 108.538 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.576 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 15.8 t -140.9 112.56 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.314 1.046 . . . . 0.0 108.805 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 m95 . . . . . 0 CA--C 1.537 0.46 0 C-N-CA 124.495 1.118 . . . . 0.0 108.947 -176.974 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.516 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 111.464 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt -113.29 150.16 32.89 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.787 1.635 . . . . 0.0 108.722 177.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.17 108.09 19.42 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.503 HD22 ' HB3' ' A' ' 43' ' ' LEU . 1.4 mm? -109.47 141.86 41.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -176.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -97.72 123.77 41.78 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.792 0.837 . . . . 0.0 109.42 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -110.17 116.6 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -177.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -132.06 139.06 48.41 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.744 0.418 . . . . 0.0 110.069 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.528 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.348 1.242 0 O-C-N 123.512 0.508 . . . . 0.0 113.892 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -140.33 126.14 19.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.84 127.09 51.59 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.543 0.687 . . . . 0.0 109.184 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -133.88 151.11 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.061 0.944 . . . . 0.0 111.474 -168.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 67.8 m -93.39 106.92 18.83 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.015 176.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HB3' HD22 ' A' ' 28' ' ' LEU . 28.9 tp -107.34 131.94 53.68 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.427 1.091 . . . . 0.0 109.309 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 35.1 m -77.8 144.64 36.94 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.623 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 11.9 ptm85 -71.05 -9.32 57.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.575 0.35 . . . . 0.0 111.934 -175.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -94.86 -30.84 13.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.415 1.086 . . . . 0.0 109.849 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 m -82.11 139.28 45.72 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.969 0.907 . . . . 0.0 109.962 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.534 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 16.4 Cg_exo -62.21 153.79 67.41 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.962 2.441 . . . . 0.0 113.6 177.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.424 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.7 mm? -53.59 -29.5 37.86 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.596 170.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.534 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -58.22 -36.96 73.93 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.08 0.552 . . . . 0.0 112.428 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.84 -33.23 75.36 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 120.976 0.417 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -73.29 -42.61 62.21 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.929 1.292 . . . . 0.0 110.792 173.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.435 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 65.9 mtt -57.06 -46.04 82.76 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.444 1.098 . . . . 0.0 110.503 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 p -69.67 -33.78 73.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.272 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.46 -52.19 59.26 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.625 0.77 . . . . 0.0 110.538 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.408 ' CZ ' HG22 ' A' ' 95' ' ' VAL . 52.5 t80 -52.92 -60.2 3.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 111.831 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.9 pt-20 -57.87 -34.19 69.5 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 124.283 0.99 . . . . 0.0 111.986 -177.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.81 -47.4 85.29 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 173.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.281 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -173.54 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.428 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 CA-C-O 121.007 0.432 . . . . 0.0 111.434 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.9 m -99.64 152.99 19.44 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.702 0.801 . . . . 0.0 110.169 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -115.59 127.25 55.09 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.751 0.82 . . . . 0.0 109.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -122.79 140.96 52.35 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.931 0.892 . . . . 0.0 110.005 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.497 ' HB3' HD21 ' A' ' 76' ' ' LEU . 67.2 t80 -129.74 114.17 15.64 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.941 0.896 . . . . 0.0 108.661 174.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 56.61 34.29 24.2 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.382 1.073 . . . . 0.0 110.459 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 79.09 -2.65 68.97 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.397 -0.819 . . . . 0.0 114.243 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 97.1 m -81.49 126.87 32.19 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 117.663 0.731 . . . . 0.0 110.233 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -71.27 116.02 11.11 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 123.735 0.647 . . . . 0.0 109.65 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.497 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.6 mt -87.51 130.32 34.76 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -92.45 -25.0 18.65 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.659 0.784 . . . . 0.0 111.489 -177.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.93 -41.56 1.77 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 123.167 0.413 . . . . 0.0 113.092 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -76.71 -18.75 58.32 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.985 0.914 . . . . 0.0 112.591 -170.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.511 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.8 pm0 -71.99 149.1 45.29 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 48' ' ' PRO . 16.6 mt -103.95 152.02 38.99 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.623 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 43.3 Cg_endo -64.03 -21.94 68.12 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.06 1.84 . . . . 0.0 111.708 -178.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.56 -44.35 89.66 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.054 0.941 . . . . 0.0 111.588 171.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -74.72 -39.71 61.74 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.614 0.766 . . . . 0.0 111.535 -176.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.511 HD21 ' HG3' ' A' ' 80' ' ' GLU . 95.0 mt -69.81 -23.27 63.3 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.07 0.548 . . . . 0.0 111.476 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.91 55.8 3.24 Favored Glycine 0 C--N 1.344 0.977 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 -174.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.433 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 61.0 mtp -107.74 159.62 16.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.075 0.95 . . . . 0.0 109.33 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -148.59 165.94 29.76 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.7 t -59.92 108.65 0.79 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 131.52 -31.95 3.02 Favored Glycine 0 C--N 1.354 1.534 0 CA-C-O 119.363 -0.687 . . . . 0.0 113.669 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.15 167.24 0.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -177.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.7 tp -131.61 110.48 10.97 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 121.468 0.652 . . . . 0.0 109.538 -162.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.413 HD12 ' HE3' ' A' ' 87' ' ' MET . 38.3 mt -90.65 148.75 4.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.354 173.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -114.92 156.91 24.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -171.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.528 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 19.0 t -135.04 109.23 11.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 m0 . . . . . 0 CA--C 1.542 0.642 0 CA-C-N 114.398 -1.273 . . . . 0.0 108.043 -176.65 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.3 mt -97.1 123.54 40.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.449 1.5 . . . . 0.0 107.734 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -85.73 103.26 14.36 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 44.2 mt -111.25 132.87 54.01 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -175.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 mtt85 -99.48 126.86 45.49 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.95 133.03 52.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.704 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.406 ' HG3' ' HA ' ' A' ' 38' ' ' THR . 0.9 OUTLIER -139.9 153.43 46.97 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.884 0.873 . . . . 0.0 108.936 174.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.527 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.34 0.764 0 O-C-N 123.526 0.516 . . . . 0.0 112.635 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.406 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 26.5 m . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.691 0.281 . . . . 0.0 110.894 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 tp -137.71 134.88 35.89 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -109.77 125.36 52.62 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -134.26 146.68 30.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.794 0.838 . . . . 0.0 110.605 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.7 p -95.55 107.68 19.87 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 175.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 52' ' ' LEU . 26.5 tp -88.49 131.14 35.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.547 -0.752 . . . . 0.0 108.992 175.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -73.82 139.88 45.41 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -61.91 -27.94 69.18 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.471 0.708 . . . . 0.0 112.477 -171.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -86.85 -27.76 23.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.101 0.96 . . . . 0.0 111.277 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -84.9 133.78 42.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.484 0.714 . . . . 0.0 110.842 -168.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.535 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 6.1 Cg_exo -60.09 157.05 36.22 Favored 'Trans proline' 0 C--N 1.378 2.113 0 C-N-CA 122.74 2.293 . . . . 0.0 113.085 177.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.0 mm? -55.02 -26.98 40.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.581 1.152 . . . . 0.0 112.236 176.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.535 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.0 pttt -59.49 -33.3 71.16 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.442 HG22 ' O ' ' A' ' 48' ' ' PRO . 3.0 t -68.76 -32.48 72.25 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.343 0.592 . . . . 0.0 110.21 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 43' ' ' LEU . 7.0 tt -74.15 -38.69 63.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.925 1.29 . . . . 0.0 110.376 173.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.9 mtt -59.04 -41.29 87.48 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.014 0.926 . . . . 0.0 110.592 176.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.424 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 24.1 m -64.44 -41.85 96.33 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 124.634 1.209 . . . . 0.0 109.789 176.033 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.42 -50.1 74.2 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.074 0.55 . . . . 0.0 110.495 -176.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -55.42 -58.01 9.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.958 0.903 . . . . 0.0 112.178 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.98 -39.1 93.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.982 -174.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 54' ' ' SER . 30.6 mm-40 -65.76 -46.33 79.19 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.102 0 C-N-CA 124.302 1.041 . . . . 0.0 113.566 -171.167 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.465 ' N ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.459 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 17.5 m -85.68 150.69 24.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.484 0.714 . . . . 0.0 110.347 -176.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -119.89 130.11 54.69 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.711 0.804 . . . . 0.0 109.88 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.437 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 17.6 m-85 -124.63 155.59 38.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.009 0.924 . . . . 0.0 110.335 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.503 ' HB3' HD21 ' A' ' 76' ' ' LEU . 56.9 t80 -140.25 112.32 7.65 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.37 1.068 . . . . 0.0 108.956 172.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 57.3 32.12 21.23 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.355 1.062 . . . . 0.0 110.995 -174.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.22 -0.45 89.71 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.645 -1.161 . . . . 0.0 114.28 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 86.3 m -83.54 122.12 28.14 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.346 0.658 . . . . 0.0 110.084 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -67.42 114.32 6.01 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.503 HD21 ' HB3' ' A' ' 71' ' ' PHE . 30.6 mt -86.42 118.93 26.17 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -78.77 -30.56 45.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.72 0.808 . . . . 0.0 112.473 -176.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.6 -47.28 1.03 Allowed Glycine 0 CA--C 1.524 0.604 0 CA-C-N 116.302 -0.408 . . . . 0.0 112.827 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -77.09 -19.74 56.64 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.439 0.696 . . . . 0.0 112.532 -169.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.431 ' HG3' HD23 ' A' ' 85' ' ' LEU . 2.1 pm0 -69.58 149.03 48.61 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.792 0.806 . . . . 0.0 109.459 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 65.3 mt -101.96 157.4 33.77 Favored Pre-proline 0 C--N 1.309 -1.194 0 C-N-CA 125.17 1.388 . . . . 0.0 108.626 -174.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -65.24 -35.02 42.96 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 121.827 1.685 . . . . 0.0 111.515 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.31 -36.39 79.99 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.716 0.806 . . . . 0.0 111.163 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.66 -46.55 75.35 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.995 0.918 . . . . 0.0 111.473 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.431 HD23 ' HG3' ' A' ' 80' ' ' GLU . 55.6 mt -75.34 -17.1 60.33 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.22 22.73 53.87 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.132 -0.486 . . . . 0.0 113.111 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.459 ' HE2' HD13 ' A' ' 49' ' ' LEU . 48.5 mtt -64.51 152.16 42.52 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.339 1.056 . . . . 0.0 112.165 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -146.91 157.23 43.58 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 -175.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 54.7 p -56.6 117.42 3.86 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.194 0.598 . . . . 0.0 111.173 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.09 -8.65 29.2 Favored Glycine 0 C--N 1.34 0.758 0 CA-C-O 119.603 -0.554 . . . . 0.0 113.501 178.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -60.06 160.33 8.21 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 117.446 0.623 . . . . 0.0 111.868 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.2 tp -124.77 108.79 12.34 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -163.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.6 mt -88.63 150.03 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 39.8 mt-10 -112.26 155.32 24.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.502 1.121 . . . . 0.0 108.216 -171.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.527 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 41.7 t -136.02 107.45 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.763 0.825 . . . . 0.0 108.836 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.459 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 9.7 m0 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.464 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 8.6 mp0 . . . . . 0 CA--C 1.533 0.313 0 CA-C-O 121.213 0.53 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 69.9 mt -97.0 125.85 41.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.28 1.032 . . . . 0.0 108.256 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -77.26 99.0 5.33 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.6 mt -112.39 133.72 54.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.481 0.712 . . . . 0.0 109.598 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -96.5 136.39 37.07 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.424 HG12 ' HB ' ' A' ' 93' ' ' ILE . 1.9 t -125.01 134.05 67.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -132.6 146.96 52.3 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 118.221 0.464 . . . . 0.0 110.496 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.563 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.345 1.035 0 O-C-N 124.023 0.827 . . . . 0.0 112.26 171.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.9 m . . . . . 0 CA--C 1.54 0.591 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -140.76 132.57 27.46 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -120.88 129.48 53.52 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -174.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.4 p -132.14 149.53 32.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.841 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.2 p -94.98 105.78 17.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.0 tp -108.09 107.55 18.25 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.697 177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 26.9 m -32.92 120.49 0.35 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 113.093 158.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.59 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.7 ptm180 -64.03 -13.61 48.22 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -172.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 44.5 p-10 -98.68 -14.22 19.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.163 0.985 . . . . 0.0 111.092 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m -92.82 141.05 23.85 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.038 0.935 . . . . 0.0 110.124 -175.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.541 ' O ' HG22 ' A' ' 51' ' ' THR . 14.6 Cg_exo -61.12 149.33 89.69 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.313 2.675 . . . . 0.0 113.201 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.666 HD11 ' HE2' ' A' ' 87' ' ' MET . 3.9 mm? -53.58 -29.86 39.37 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.036 -0.983 . . . . 0.0 112.336 172.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.469 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -54.89 -37.78 66.75 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.502 0.721 . . . . 0.0 112.307 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.541 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.4 t -69.42 -36.83 77.09 Favored 'General case' 0 CA--C 1.554 1.133 0 O-C-N 123.118 0.262 . . . . 0.0 110.58 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.01 -45.18 82.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.293 1.037 . . . . 0.0 110.531 175.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.488 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -54.94 -47.35 74.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.129 176.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 t -66.81 -33.79 76.4 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.463 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -67.29 -49.86 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.423 0.689 . . . . 0.0 110.159 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.439 ' CZ ' HG23 ' A' ' 95' ' ' VAL . 46.7 t80 -54.98 -60.77 2.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.167 0.987 . . . . 0.0 111.449 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.4 pt-20 -62.7 -39.38 93.81 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.549 -173.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.78 -37.75 85.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 175.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -179.827 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.421 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.971 0.415 . . . . 0.0 110.758 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.434 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 50.0 m -89.46 162.62 15.64 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.105 -177.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.461 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 45.2 m-85 -132.27 128.12 37.13 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.489 1.116 . . . . 0.0 109.249 -174.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.508 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 31.6 m-85 -125.15 122.66 37.74 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.54 0.736 . . . . 0.0 110.636 -177.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.548 ' HB3' HD23 ' A' ' 76' ' ' LEU . 27.5 t80 -98.73 106.89 19.21 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 52.01 46.11 27.15 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.259 1.023 . . . . 0.0 111.618 -171.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 76.5 1.03 69.28 Favored Glycine 0 C--N 1.347 1.175 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.907 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 54.5 m -86.64 113.02 22.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.499 0.72 . . . . 0.0 109.303 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -59.02 115.4 3.12 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.818 0.698 . . . . 0.0 109.512 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.548 HD23 ' HB3' ' A' ' 71' ' ' PHE . 56.6 mt -88.5 127.65 35.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.131 0.972 . . . . 0.0 108.863 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.4 t -81.44 -25.55 36.05 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.697 0.799 . . . . 0.0 111.422 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.74 -47.86 1.0 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 123.78 0.705 . . . . 0.0 112.436 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -93.97 11.28 30.19 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.665 0.786 . . . . 0.0 112.365 -168.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.518 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -85.88 150.17 24.71 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 165.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.1 mt -102.26 160.37 26.57 Favored Pre-proline 0 C--N 1.309 -1.184 0 C-N-CA 124.806 1.242 . . . . 0.0 107.922 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.59 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 36.7 Cg_endo -67.22 -20.08 49.79 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.423 1.415 . . . . 0.0 111.839 171.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.88 92.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.4 0.68 . . . . 0.0 110.564 168.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -75.2 -45.46 40.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.038 0.935 . . . . 0.0 110.723 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.518 HD21 ' HG3' ' A' ' 80' ' ' GLU . 96.0 mt -68.66 -23.97 64.48 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.029 0.932 . . . . 0.0 112.783 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 71.53 64.51 2.71 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.666 ' HE2' HD11 ' A' ' 49' ' ' LEU . 30.7 ttp -128.39 153.78 46.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.35 1.06 . . . . 0.0 108.721 -173.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -149.49 167.18 26.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.598 0.759 . . . . 0.0 109.1 -170.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 m -55.71 117.85 4.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.463 0.705 . . . . 0.0 111.323 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 120.94 -21.79 8.24 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-O 119.816 -0.435 . . . . 0.0 113.245 177.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.32 169.29 0.89 Allowed 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.61 110.51 9.95 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.917 -166.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.424 ' HB ' HG12 ' A' ' 30' ' ' VAL . 62.1 mt -95.46 150.29 4.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.415 175.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.508 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 34.9 mt-10 -109.96 165.06 12.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.038 0.935 . . . . 0.0 108.7 -171.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.563 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 46.0 t -139.89 109.49 3.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 123.995 0.918 . . . . 0.0 108.912 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 74.2 m95 . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.574 1.149 . . . . 0.0 108.69 -178.074 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.442 ' OE1' ' HB3' ' A' ' 42' ' ' SER . 3.9 pp0? . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 122.065 0.936 . . . . 0.0 112.892 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.96 134.02 38.08 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.799 -160.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.62 103.37 15.76 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 45.2 mt -109.33 130.6 55.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.004 0.522 . . . . 0.0 109.935 -174.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -92.94 128.56 38.85 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.86 121.31 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -173.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -127.62 137.44 52.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.773 0.429 . . . . 0.0 109.887 -171.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.567 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.343 0.942 0 O-C-N 123.745 0.653 . . . . 0.0 112.46 176.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.1 m . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.68 122.83 20.4 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -115.46 122.72 46.63 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.025 0.917 . . . . 0.0 109.355 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.82 147.44 29.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.793 0 C-N-CA 125.045 1.338 . . . . 0.0 109.484 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.442 ' HB3' ' OE1' ' A' ' 25' ' ' GLN . 6.0 m -90.86 107.15 19.0 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 27.3 tp -104.71 131.61 51.95 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.749 0.82 . . . . 0.0 109.026 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.3 m -75.88 137.15 40.23 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.656 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 9.1 ptm180 -72.21 -6.79 45.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.742 0.306 . . . . 0.0 111.746 -175.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -92.4 -37.7 12.42 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.646 1.178 . . . . 0.0 109.887 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 m -78.01 132.55 67.06 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.599 0.76 . . . . 0.0 110.682 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 81' ' ' LEU . 10.7 Cg_endo -64.54 162.07 32.6 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.545 2.163 . . . . 0.0 113.974 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.52 HD12 ' HE3' ' A' ' 87' ' ' MET . 3.5 mm? -53.92 -28.03 34.32 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.433 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.83 -36.22 58.41 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -177.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 48' ' ' PRO . 10.9 t -73.26 -33.76 65.45 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 120.892 0.377 . . . . 0.0 111.129 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.72 -42.7 85.92 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.258 1.023 . . . . 0.0 110.322 172.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.465 ' HE1' ' HB3' ' A' ' 49' ' ' LEU . 66.1 mtt -58.63 -49.36 77.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.558 1.143 . . . . 0.0 110.636 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.8 p -67.15 -32.84 74.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 124.813 1.321 . . . . 0.0 109.778 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -67.43 -53.5 28.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 122.845 0.458 . . . . 0.0 110.065 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -55.27 -60.16 3.79 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.613 1.165 . . . . 0.0 111.389 -178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 53' ' ' MET . 12.3 pt-20 -56.91 -49.87 74.28 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.015 0.822 . . . . 0.0 110.901 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.26 -27.1 66.04 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.237 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.414 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 120.962 0.411 . . . . 0.0 109.998 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.412 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 41.3 m -87.82 130.81 34.75 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.495 -173.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -101.64 133.05 46.94 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.121 0.969 . . . . 0.0 110.035 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.475 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 98.3 m-85 -128.73 132.39 47.97 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.306 0.642 . . . . 0.0 111.175 177.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.465 ' HB3' HD21 ' A' ' 76' ' ' LEU . 15.7 t80 -120.63 108.52 14.12 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.6 t70 59.5 26.22 15.15 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-O 122.045 0.926 . . . . 0.0 110.456 -172.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.75 -2.9 87.33 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.517 -0.765 . . . . 0.0 114.272 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 70' ' ' PHE . 90.9 m -73.51 125.92 29.04 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 117.581 0.69 . . . . 0.0 110.197 175.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -68.66 114.03 6.67 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 123.62 0.575 . . . . 0.0 109.64 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.465 HD21 ' HB3' ' A' ' 71' ' ' PHE . 12.2 mt -93.95 124.59 38.05 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 175.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.2 m -111.56 -14.19 13.71 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.31 -63.17 0.54 Allowed Glycine 0 C--N 1.345 1.065 0 N-CA-C 113.599 0.2 . . . . 0.0 113.599 176.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -77.8 -5.14 49.79 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -167.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -81.43 147.63 29.67 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 17.6 mt -99.6 153.16 37.91 Favored Pre-proline 0 C--N 1.312 -1.056 0 C-N-CA 125.343 1.457 . . . . 0.0 108.128 -176.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.656 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 50.0 Cg_endo -66.29 -36.23 28.74 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 121.768 1.645 . . . . 0.0 111.317 177.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.14 75.2 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.083 0.553 . . . . 0.0 110.966 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -65.94 -43.7 87.26 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.778 . . . . 0.0 110.624 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.6 mt -74.85 -24.83 58.65 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.63 0.772 . . . . 0.0 111.999 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 91.47 55.21 1.83 Allowed Glycine 0 C--N 1.343 0.919 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.52 ' HE3' HD12 ' A' ' 49' ' ' LEU . 63.4 mtt -104.34 161.87 13.7 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.986 0.914 . . . . 0.0 110.653 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.5 tp10 -148.9 160.42 43.27 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.928 0.891 . . . . 0.0 108.689 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 t -62.66 118.07 7.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.347 0.659 . . . . 0.0 110.72 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.34 41.19 3.04 Favored Glycine 0 C--N 1.34 0.771 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -173.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.5 t0 -103.9 -175.75 2.89 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.338 0.655 . . . . 0.0 109.444 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 30.9 tp -138.66 134.79 34.14 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.472 0.653 . . . . 0.0 109.447 -174.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 54.1 mt -126.54 150.39 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.923 1.289 . . . . 0.0 108.194 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 28.5 mt-10 -117.88 156.4 28.49 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 -171.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.567 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 10.2 t -140.14 139.41 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.567 0.747 . . . . 0.0 110.265 -174.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.1 m95 . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 124.812 1.245 . . . . 0.0 109.653 -175.528 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 . . . . . 0 C--O 1.238 0.488 0 CA-C-O 121.561 0.696 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.462 HD12 ' HB2' ' A' ' 82' ' ' PRO . 44.6 mt -99.01 123.36 43.25 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.306 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -87.28 101.87 13.95 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.626 HD13 ' SD ' ' A' ' 87' ' ' MET . 28.2 mt -113.55 154.7 26.68 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.498 0.719 . . . . 0.0 111.203 -168.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.6 mtm105 -112.19 136.28 51.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.188 0.595 . . . . 0.0 110.955 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -120.29 126.04 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.216 1.407 . . . . 0.0 108.899 173.585 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -129.12 129.16 44.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.601 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.344 0.991 0 O-C-N 123.729 0.643 . . . . 0.0 113.63 -172.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.1 m . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.441 ' HB3' HG23 ' A' ' 30' ' ' VAL . 1.5 tm? -128.57 128.13 43.67 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -121.16 121.31 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.765 0.793 . . . . 0.0 109.542 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -128.15 144.83 36.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 124.817 1.247 . . . . 0.0 110.823 -171.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p -93.39 112.17 24.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.814 0.845 . . . . 0.0 109.489 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.435 ' HB3' HD11 ' A' ' 28' ' ' LEU . 36.8 tp -110.09 133.9 52.73 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.924 0.889 . . . . 0.0 109.41 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 67.3 m -77.18 147.08 36.66 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.656 0.382 . . . . 0.0 109.992 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.455 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 8.9 ptm180 -64.62 -25.9 68.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.663 0.785 . . . . 0.0 111.853 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -99.69 -16.05 18.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.258 1.023 . . . . 0.0 111.096 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.2 m -88.42 135.99 32.08 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.701 0.8 . . . . 0.0 109.438 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.518 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 2.8 Cg_endo -65.9 155.03 71.47 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 122.697 2.265 . . . . 0.0 113.283 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.542 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.4 mm? -53.04 -29.9 32.53 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 125.137 1.375 . . . . 0.0 112.255 176.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.518 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.2 pttt -55.96 -35.47 66.74 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.463 HG23 ' O ' ' A' ' 48' ' ' PRO . 7.0 t -70.3 -32.85 70.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.0 tt -70.85 -37.6 73.12 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.599 1.16 . . . . 0.0 110.235 173.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.2 mtt -61.99 -42.09 98.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.01 0.924 . . . . 0.0 110.397 176.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.5 m -66.92 -38.58 86.47 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 124.534 1.146 . . . . 0.0 110.227 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.76 -45.6 70.98 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 122.989 0.516 . . . . 0.0 110.311 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.83 -57.96 9.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.219 1.008 . . . . 0.0 111.8 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.1 -42.51 98.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 123.946 0.779 . . . . 0.0 110.512 -174.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.58 -29.48 70.08 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 177.963 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.418 HD12 ' N ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.294 0.092 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.0 m -98.16 168.09 10.47 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.253 0.621 . . . . 0.0 111.156 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -130.99 132.12 44.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.159 1.383 . . . . 0.0 109.007 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -127.73 112.4 14.76 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.753 0.821 . . . . 0.0 110.603 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.517 ' HB3' HD21 ' A' ' 76' ' ' LEU . 10.8 t80 -102.23 111.72 24.11 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.677 1.191 . . . . 0.0 107.819 174.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.4 t70 52.47 36.16 19.52 Favored 'General case' 0 CA--C 1.564 1.495 0 CA-C-O 121.977 0.894 . . . . 0.0 110.836 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 85.75 -16.12 43.21 Favored Glycine 0 N--CA 1.478 1.466 0 CA-C-N 115.062 -0.972 . . . . 0.0 114.745 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.5 m -70.51 121.0 16.99 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.287 0.635 . . . . 0.0 110.789 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -71.23 119.71 15.75 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.517 HD21 ' HB3' ' A' ' 71' ' ' PHE . 45.0 mt -91.37 126.82 36.58 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 124.289 1.036 . . . . 0.0 109.403 -177.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.7 m -90.35 -22.97 21.25 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.892 0.877 . . . . 0.0 112.38 -176.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.21 -49.72 0.92 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 120.103 -0.276 . . . . 0.0 113.604 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.4 mtm180 -82.54 1.29 38.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.703 0.801 . . . . 0.0 112.866 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -85.26 148.12 26.22 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.4 156.8 34.82 Favored Pre-proline 0 C--N 1.313 -1.0 0 C-N-CA 125.045 1.338 . . . . 0.0 108.097 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HB2' HD12 ' A' ' 26' ' ' LEU . 73.7 Cg_endo -69.32 -25.06 31.01 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 121.531 1.487 . . . . 0.0 111.126 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.48 83.97 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.324 0.649 . . . . 0.0 110.56 171.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -67.11 -40.5 86.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.415 ' HB3' ' CE2' ' A' ' 71' ' ' PHE . 88.5 mt -73.55 -23.61 60.0 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.198 0.999 . . . . 0.0 111.902 176.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.78 23.68 52.11 Favored Glycine 0 C--N 1.349 1.288 0 O-C-N 123.236 0.335 . . . . 0.0 112.858 -176.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.626 ' SD ' HD13 ' A' ' 28' ' ' LEU . 32.8 ttm -73.85 160.66 31.11 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.388 1.475 . . . . 0.0 110.848 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -140.04 157.19 46.04 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.094 0.957 . . . . 0.0 109.548 -176.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.5 m -56.45 119.49 6.13 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.358 0.663 . . . . 0.0 111.119 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.46 -15.37 32.47 Favored Glycine 0 N--CA 1.475 1.262 0 CA-C-O 119.727 -0.485 . . . . 0.0 113.91 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.64 175.85 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.54 1.136 . . . . 0.0 112.561 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.4 tp -130.79 107.66 9.3 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -172.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.1 mt -89.75 149.85 3.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 168.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -115.79 163.45 15.82 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.601 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 98.8 t -135.76 119.61 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.3 m95 . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 124.362 1.065 . . . . 0.0 109.333 -176.965 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 C--O 1.236 0.372 0 CA-C-O 121.654 0.74 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.9 mt -92.71 128.39 38.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.26 -163.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -83.85 99.82 10.57 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.487 HD13 ' SD ' ' A' ' 87' ' ' MET . 64.9 mt -110.89 130.77 55.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.868 0.867 . . . . 0.0 109.63 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 -99.15 112.11 24.33 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.018 0.527 . . . . 0.0 109.855 -176.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -100.48 119.65 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.914 0.886 . . . . 0.0 109.435 176.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -123.27 134.69 54.07 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -174.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.431 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.352 1.42 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 173.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 40.8 m . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -129.44 121.06 26.54 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -113.24 125.3 54.16 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.286 0.565 . . . . 0.0 109.72 -176.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -132.34 148.39 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.736 1.214 . . . . 0.0 110.599 -174.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.4 p -102.29 105.24 15.84 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.443 ' HB3' HD11 ' A' ' 28' ' ' LEU . 34.2 tp -91.53 135.84 33.56 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.573 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.4 m -74.19 136.69 42.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.7 ptm180 -71.51 -15.82 62.32 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -168.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -92.67 -36.73 12.79 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.988 0.915 . . . . 0.0 110.336 172.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -66.71 143.0 97.88 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 123.545 0.738 . . . . 0.0 111.249 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.432 ' O ' HG22 ' A' ' 51' ' ' THR . 0.9 OUTLIER -71.62 162.74 41.2 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.616 2.211 . . . . 0.0 113.1 176.873 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -56.06 -26.12 47.98 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.731 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.427 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 62.2 pttt -58.32 -37.53 75.27 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -70.56 -30.77 67.58 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 118.439 0.563 . . . . 0.0 110.82 178.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.99 -40.74 78.58 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.176 0.991 . . . . 0.0 110.428 172.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.458 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 65.1 mtt -58.41 -45.13 89.02 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.283 1.033 . . . . 0.0 110.046 175.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -66.28 -35.95 81.72 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 124.993 1.433 . . . . 0.0 110.703 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -68.88 -47.43 65.88 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.097 0.559 . . . . 0.0 110.258 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.36 -59.05 5.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.473 1.109 . . . . 0.0 111.819 177.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 53' ' ' MET . 10.5 pt-20 -62.54 -46.6 87.64 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.349 1.03 . . . . 0.0 111.401 -174.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -65.54 -34.53 78.47 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.237 0 C-N-CA 123.491 0.716 . . . . 0.0 112.301 178.121 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.789 0 CA-C-O 121.03 0.443 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.4 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 45.5 m -104.71 166.36 10.44 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.031 0.932 . . . . 0.0 110.451 178.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.408 ' HB3' HD12 ' A' ' 76' ' ' LEU . 65.2 m-85 -136.08 129.65 32.2 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.883 1.273 . . . . 0.0 108.722 -179.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.73 133.93 50.77 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.584 0.753 . . . . 0.0 111.023 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.453 ' HB3' HD23 ' A' ' 76' ' ' LEU . 54.2 t80 -129.13 116.61 19.49 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.533 1.133 . . . . 0.0 108.292 171.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.5 t70 59.05 30.47 20.28 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.492 1.117 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 87.68 -19.78 31.25 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 113.37 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.8 m -65.29 120.14 12.21 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.621 0.768 . . . . 0.0 110.494 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -68.88 113.52 6.38 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.453 HD23 ' HB3' ' A' ' 71' ' ' PHE . 31.7 mt -82.62 119.44 24.28 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -85.94 -31.02 22.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.366 1.066 . . . . 0.0 112.315 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.7 10.49 23.04 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.803 -172.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -123.54 10.46 9.12 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.538 1.135 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -112.45 148.08 35.15 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.7 mt -102.21 156.65 34.98 Favored Pre-proline 0 C--N 1.313 -0.991 0 C-N-CA 125.37 1.468 . . . . 0.0 107.767 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.422 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.5 Cg_endo -67.57 -21.43 46.03 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.407 1.405 . . . . 0.0 110.894 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.2 76.25 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.017 0.927 . . . . 0.0 110.719 170.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.08 -42.35 89.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.016 0.926 . . . . 0.0 111.431 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.8 mt -74.18 -24.47 59.38 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 76.37 68.7 1.49 Allowed Glycine 0 C--N 1.351 1.374 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -173.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.487 ' SD ' HD13 ' A' ' 28' ' ' LEU . 43.8 ttm -118.65 160.19 22.26 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.47 1.108 . . . . 0.0 109.8 -172.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -124.03 166.14 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.275 0.63 . . . . 0.0 109.986 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 t -76.63 15.22 0.66 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.172 0.989 . . . . 0.0 113.174 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -151.94 55.98 0.45 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -103.71 -175.05 2.69 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.033 -173.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.4 tp -143.84 107.38 4.61 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.5 mt -94.22 150.09 4.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.903 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -105.6 158.25 16.82 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.431 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.2 t -136.87 124.46 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 86.4 m95 . . . . . 0 N--CA 1.47 0.533 0 C-N-CA 123.618 0.767 . . . . 0.0 109.695 -176.55 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 . . . . . 0 CA--C 1.545 0.75 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.6 mt -107.32 134.84 49.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.918 1.287 . . . . 0.0 108.626 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -83.06 101.36 11.08 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.545 HD11 ' SD ' ' A' ' 87' ' ' MET . 90.3 mt -110.51 124.21 51.38 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.956 0.502 . . . . 0.0 111.225 -170.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -87.68 138.12 31.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.188 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.57 124.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 125.238 1.415 . . . . 0.0 108.103 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -122.97 129.05 51.05 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -175.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.645 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.877 0 N-CA-C 114.739 0.656 . . . . 0.0 114.739 -176.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 39.8 m . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -128.01 136.86 51.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -125.23 128.27 48.04 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.055 0.843 . . . . 0.0 110.272 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -133.96 144.25 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.451 1.1 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.2 m -94.14 107.23 19.17 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.525 ' HB3' HD12 ' A' ' 28' ' ' LEU . 43.1 tp -93.48 134.97 35.18 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.009 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.3 m -77.68 141.2 39.52 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.1 ptm180 -63.4 -26.05 68.57 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.15 -15.98 24.15 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.784 0.834 . . . . 0.0 110.621 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.0 m -88.74 132.84 37.28 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.479 ' O ' HG23 ' A' ' 51' ' ' THR . 1.0 OUTLIER -69.0 163.61 37.0 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.484 2.122 . . . . 0.0 113.359 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.52 HD12 ' HE3' ' A' ' 87' ' ' MET . 4.1 mm? -57.26 -26.37 60.69 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.882 177.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.403 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 59.5 pttt -58.62 -36.89 74.78 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.479 HG23 ' O ' ' A' ' 48' ' ' PRO . 6.3 t -72.56 -30.42 64.4 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-O 120.924 0.392 . . . . 0.0 110.661 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -71.7 -40.32 69.59 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.262 1.025 . . . . 0.0 110.304 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.477 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 63.4 mtt -56.37 -43.88 79.63 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.234 1.013 . . . . 0.0 110.462 173.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.0 t -64.1 -41.61 97.21 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 124.955 1.409 . . . . 0.0 109.837 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -66.91 -46.01 76.16 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.221 0.608 . . . . 0.0 110.962 -174.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.12 -60.85 2.91 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.699 0.8 . . . . 0.0 111.692 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.2 pt-20 -59.55 -40.6 87.83 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.91 0.757 . . . . 0.0 111.786 -176.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -64.97 -40.26 94.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.34 0 C-N-CA 123.674 0.789 . . . . 0.0 112.388 -179.114 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 121.135 0.493 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.468 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 56.4 m -104.49 169.09 8.67 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.138 0.975 . . . . 0.0 109.885 176.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.409 ' HB2' ' HE1' ' A' ' 53' ' ' MET . 18.4 m-85 -130.73 132.19 45.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.266 1.027 . . . . 0.0 109.0 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -127.76 121.87 31.35 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.852 0.861 . . . . 0.0 111.023 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.528 ' HB3' HD22 ' A' ' 76' ' ' LEU . 42.7 t80 -102.43 109.79 21.55 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 52.92 40.9 31.75 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.385 1.074 . . . . 0.0 111.087 -171.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 73.94 4.23 66.53 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 114.838 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 94.4 m -81.24 120.88 25.46 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.77 0.785 . . . . 0.0 109.185 173.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.468 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 3.1 tmtp? -69.42 113.12 6.44 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.528 HD22 ' HB3' ' A' ' 71' ' ' PHE . 33.5 mt -83.64 116.66 22.73 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.8 m -71.66 -27.31 62.98 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.844 0.858 . . . . 0.0 111.4 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 127.97 -44.38 1.24 Allowed Glycine 0 C--N 1.346 1.103 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.376 -177.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -80.47 -1.22 40.75 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -171.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -76.25 148.31 37.7 Favored 'General case' 0 C--N 1.347 0.467 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -102.87 149.86 37.22 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.998 1.319 . . . . 0.0 107.779 174.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.429 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 53.5 Cg_endo -66.5 -25.78 47.77 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 121.575 1.517 . . . . 0.0 111.298 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.21 96.99 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.664 0.786 . . . . 0.0 111.133 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.05 -43.48 74.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.761 0.825 . . . . 0.0 111.221 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 76.7 mt -72.17 -19.82 61.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.716 0.806 . . . . 0.0 111.757 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.94 51.24 5.93 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.545 ' SD ' HD11 ' A' ' 28' ' ' LEU . 41.7 ttm -106.36 156.55 18.4 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.831 1.252 . . . . 0.0 109.137 -174.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.9 tt0 -139.47 160.06 40.71 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.004 0.521 . . . . 0.0 110.89 -170.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.7 m -61.85 117.78 6.33 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.232 0.613 . . . . 0.0 110.333 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.15 48.77 4.47 Favored Glycine 0 C--N 1.338 0.676 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.6 t0 -102.87 -160.89 0.81 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.8 tp -142.75 109.79 5.57 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.624 0.726 . . . . 0.0 109.042 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.476 HD12 HD11 ' A' ' 28' ' ' LEU . 45.2 mt -101.0 148.35 7.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 167.448 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -115.56 162.02 17.8 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.645 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 24.6 t -138.41 103.92 2.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.1 m95 . . . . . 0 N--CA 1.471 0.578 0 C-N-CA 123.238 0.615 . . . . 0.0 110.206 -174.865 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -117.3 151.84 36.12 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.09 1.356 . . . . 0.0 108.729 -174.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -99.19 103.96 15.88 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 91' ' ' ASP . 2.2 mm? -100.56 127.91 46.78 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.49 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 93.1 mtt180 -92.5 105.14 17.37 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.164 0.586 . . . . 0.0 110.25 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -99.37 118.24 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.155 -172.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.446 ' NE2' HD12 ' A' ' 92' ' ' LEU . 26.7 mt-30 -125.6 128.26 47.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.013 0.525 . . . . 0.0 110.58 -170.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.65 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.346 1.103 0 O-C-N 123.58 0.55 . . . . 0.0 113.625 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.9 m . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.1 tp -130.64 152.34 50.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.49 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.7 pt-20 -133.04 132.29 41.65 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 164.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -134.25 148.57 29.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 123.779 0.832 . . . . 0.0 109.662 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 m -92.08 109.4 20.76 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.275 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.474 ' HB3' HD23 ' A' ' 28' ' ' LEU . 56.7 tp -105.75 133.08 51.06 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.925 177.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -77.44 146.64 36.4 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.534 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 15.0 ptm180 -66.57 -20.76 66.09 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.324 0.65 . . . . 0.0 112.161 -174.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.75 -18.51 22.84 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.399 1.08 . . . . 0.0 110.899 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.0 m -93.5 126.1 51.43 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 123.712 0.805 . . . . 0.0 109.542 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.447 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 9.9 Cg_endo -65.98 164.41 27.45 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.138 1.892 . . . . 0.0 113.826 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.471 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -59.94 -25.92 65.55 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.106 -177.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.447 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 65.0 pttt -57.34 -38.03 73.47 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 48' ' ' PRO . 14.3 t -70.45 -31.31 68.42 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 117.819 0.281 . . . . 0.0 110.53 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -69.47 -42.12 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.231 1.012 . . . . 0.0 110.276 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -56.96 -44.89 83.05 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.424 1.089 . . . . 0.0 110.505 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.8 m -67.56 -39.14 84.93 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 113.89 -1.505 . . . . 0.0 110.134 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -65.17 -45.87 83.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.968 0.507 . . . . 0.0 110.164 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -55.9 -60.36 3.58 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.78 1.232 . . . . 0.0 111.722 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.77 -38.09 86.72 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.584 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -65.9 -35.32 80.31 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 121.868 -0.52 . . . . 0.0 111.89 175.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.238 0 C-N-CA 123.461 0.704 . . . . 0.0 112.798 -177.833 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.438 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.0 m -87.11 159.89 18.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.377 0.671 . . . . 0.0 111.241 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.83 129.14 40.06 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -128.87 143.1 50.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.03 0.932 . . . . 0.0 111.69 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.547 ' HB3' HD21 ' A' ' 76' ' ' LEU . 16.2 t80 -133.67 104.32 6.29 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.914 1.685 . . . . 0.0 107.845 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t70 55.18 30.45 14.54 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 122.519 1.152 . . . . 0.0 111.841 -174.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 88.3 -3.66 85.42 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 114.94 -1.027 . . . . 0.0 113.679 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.0 m -75.54 113.94 13.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.442 0.697 . . . . 0.0 109.596 174.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -66.88 113.59 5.05 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 173.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.547 HD21 ' HB3' ' A' ' 71' ' ' PHE . 38.8 mt -78.94 112.19 15.88 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.252 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.0 m -78.95 -26.65 43.56 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.94 0.896 . . . . 0.0 112.672 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.04 -45.73 1.1 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.618 -178.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.16 4.83 44.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 111.431 -164.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.484 ' HG3' HD22 ' A' ' 85' ' ' LEU . 1.2 pm0 -91.75 147.99 22.58 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.5 mt -98.2 156.21 36.09 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 125.71 1.604 . . . . 0.0 109.108 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.534 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 54.6 Cg_endo -66.76 -23.95 47.79 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 121.546 1.498 . . . . 0.0 111.485 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 -37.52 68.81 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.677 0.791 . . . . 0.0 111.188 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -62.63 -42.47 99.61 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.805 0.842 . . . . 0.0 110.48 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.484 HD22 ' HG3' ' A' ' 80' ' ' GLU . 76.8 mt -79.25 -24.0 43.3 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.81 0.844 . . . . 0.0 111.348 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 73.64 64.8 2.38 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 -175.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 70.2 mtp -106.87 170.85 7.7 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.9 0.88 . . . . 0.0 110.391 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -126.83 169.51 13.15 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.958 0.903 . . . . 0.0 109.954 -177.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -75.1 11.78 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.787 0.835 . . . . 0.0 112.503 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -148.58 46.77 0.67 Allowed Glycine 0 C--N 1.34 0.797 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.523 ' HB3' HD12 ' A' ' 28' ' ' LEU . 7.2 t70 -93.04 176.64 6.34 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.446 HD12 ' NE2' ' A' ' 31' ' ' GLN . 28.6 tp -131.4 118.88 20.87 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -172.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 44.6 mt -106.63 147.24 12.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 170.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -124.54 155.67 38.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -175.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.65 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 11.6 t -135.12 126.76 46.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 123.343 0.657 . . . . 0.0 109.242 -171.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.8 m95 . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 124.246 1.018 . . . . 0.0 109.395 -174.399 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.521 ' NE2' ' HB2' ' A' ' 42' ' ' SER . 19.4 pt20 . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 121.146 0.498 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.515 HD13 ' HB2' ' A' ' 82' ' ' PRO . 57.5 mt -110.59 135.11 51.73 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.778 1.231 . . . . 0.0 108.577 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -90.8 103.84 16.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 35.3 mt -109.65 132.97 53.65 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.185 -0.322 . . . . 0.0 110.329 -171.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -95.2 140.68 29.78 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -129.7 132.37 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -173.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -135.84 141.94 44.74 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.065 0.393 . . . . 0.0 110.866 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.639 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.347 1.141 0 O-C-N 123.683 0.615 . . . . 0.0 113.306 177.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 120.694 0.283 . . . . 0.0 110.77 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.57 121.16 18.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.33 1.052 . . . . 0.0 108.204 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -105.11 116.23 31.59 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -123.6 144.95 31.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 123.992 0.917 . . . . 0.0 110.251 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.521 ' HB2' ' NE2' ' A' ' 25' ' ' GLN . 25.8 p -91.19 110.02 21.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 44.6 tp -109.59 134.16 52.26 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.735 0.814 . . . . 0.0 108.813 177.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 57.4 m -73.57 142.77 46.62 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 176.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.505 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 35.5 ptt180 -62.49 -27.64 69.28 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.2 0.6 . . . . 0.0 112.13 -173.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -95.92 -9.94 30.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.729 0.811 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.42 ' OG ' ' HB2' ' A' ' 44' ' ' SER . 66.4 m -90.13 139.67 27.24 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 123.681 0.793 . . . . 0.0 109.443 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.576 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 7.2 Cg_exo -65.88 157.45 59.06 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.872 2.381 . . . . 0.0 113.093 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.6 mm? -58.11 -27.8 64.06 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.519 173.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.576 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 61.2 pttt -58.09 -38.07 75.7 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.604 0.638 . . . . 0.0 112.608 -177.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 48' ' ' PRO . 13.2 t -72.49 -29.39 63.6 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 120.817 0.341 . . . . 0.0 110.454 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 tt -69.72 -42.52 73.9 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.885 0.874 . . . . 0.0 110.099 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -56.9 -46.86 81.64 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.344 1.058 . . . . 0.0 110.51 177.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.7 t -64.36 -35.57 81.32 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.404 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -68.7 -46.32 69.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.381 0.672 . . . . 0.0 110.216 -178.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -57.39 -60.15 4.08 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.359 1.064 . . . . 0.0 111.823 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.15 -32.81 73.46 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.84 0.712 . . . . 0.0 111.787 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -73.44 -38.54 65.48 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 C-N-CA 123.724 0.81 . . . . 0.0 112.669 -175.335 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.767 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 21.3 m -86.57 162.32 18.07 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.406 0.683 . . . . 0.0 111.243 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -131.22 126.76 36.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.394 1.078 . . . . 0.0 109.152 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.408 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 9.6 m-85 -123.44 151.29 42.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.618 0.767 . . . . 0.0 110.762 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.554 ' HB3' HD21 ' A' ' 76' ' ' LEU . 22.2 t80 -137.25 114.11 10.52 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 172.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.8 25.68 15.21 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.794 0.838 . . . . 0.0 110.824 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 78.03 4.46 86.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.561 -174.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.0 m -82.82 120.2 25.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.785 0.834 . . . . 0.0 109.066 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tmtp? -68.12 115.29 7.44 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.554 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.4 mt -81.97 112.06 18.71 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.0 t -71.87 -34.22 69.03 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.767 0.827 . . . . 0.0 111.979 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.86 -9.43 11.43 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 116.009 -0.541 . . . . 0.0 113.356 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -109.82 10.97 24.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.476 ' HG3' HD22 ' A' ' 85' ' ' LEU . 1.4 pm0 -101.74 147.92 25.89 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -98.86 156.26 35.74 Favored Pre-proline 0 C--N 1.312 -1.023 0 C-N-CA 125.183 1.393 . . . . 0.0 108.683 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.515 ' HB2' HD13 ' A' ' 26' ' ' LEU . 49.4 Cg_endo -65.38 -33.02 49.15 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.799 1.666 . . . . 0.0 111.072 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.16 79.64 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.848 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.49 -42.93 77.95 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.935 0.894 . . . . 0.0 111.683 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.476 HD22 ' HG3' ' A' ' 80' ' ' GLU . 85.0 mt -70.95 -22.98 62.15 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.447 0.699 . . . . 0.0 111.293 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 99.06 17.67 26.79 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.724 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.3 mtt -71.06 166.9 20.41 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.777 0.831 . . . . 0.0 111.627 177.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -166.19 2.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.197 0.999 . . . . 0.0 109.67 175.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.7 m -78.64 12.83 1.87 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -165.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -162.09 63.23 0.27 Allowed Glycine 0 C--N 1.352 1.426 0 CA-C-N 118.245 0.475 . . . . 0.0 112.22 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.44 -168.65 1.72 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.693 0.397 . . . . 0.0 110.038 -170.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.3 tp -139.83 127.5 21.78 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.827 0.851 . . . . 0.0 109.23 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.4 mt -121.2 152.63 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.935 1.294 . . . . 0.0 108.448 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.408 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 30.8 mt-10 -114.04 160.73 18.56 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.793 1.237 . . . . 0.0 107.899 -173.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.639 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 9.4 t -137.26 107.88 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.85 0.86 . . . . 0.0 109.034 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.2 m0 . . . . . 0 CA--C 1.541 0.622 0 C-N-CA 124.218 1.007 . . . . 0.0 108.656 -176.936 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.464 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 4.3 pp0? . . . . . 0 C--O 1.24 0.563 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.73 125.21 49.38 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.149 1.38 . . . . 0.0 109.437 -166.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -80.07 100.53 8.24 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 176.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.7 mt -114.13 128.86 56.57 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.767 0.427 . . . . 0.0 110.049 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -95.33 132.05 40.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 93' ' ' ILE . 2.8 t -123.17 129.42 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -174.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -129.55 130.59 45.95 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.578 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.346 1.11 0 O-C-N 123.368 0.417 . . . . 0.0 113.335 -177.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m . . . . . 0 C--O 1.236 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -128.0 113.53 15.95 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 -170.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -106.74 121.98 45.45 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -172.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -132.01 147.11 32.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.854 0.862 . . . . 0.0 110.832 -171.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.8 m -90.9 111.62 23.13 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.248 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.488 HD21 HD22 ' A' ' 49' ' ' LEU . 29.2 tp -114.62 121.24 42.81 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.254 0.621 . . . . 0.0 109.523 175.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 21.3 m -75.16 149.13 39.09 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.537 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 30.6 ptt180 -69.94 -13.47 62.26 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -99.42 -19.62 16.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.498 0.719 . . . . 0.0 109.665 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.463 ' HB3' HG23 ' A' ' 51' ' ' THR . 58.0 m -85.54 133.4 42.15 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.197 0.999 . . . . 0.0 109.597 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.443 ' O ' HG22 ' A' ' 51' ' ' THR . 3.3 Cg_exo -71.77 159.42 50.75 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.488 HD22 HD21 ' A' ' 43' ' ' LEU . 2.7 mm? -53.85 -30.69 46.66 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.06 1.344 . . . . 0.0 111.774 177.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -39.76 58.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.007 0.923 . . . . 0.0 112.935 177.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.463 HG23 ' HB3' ' A' ' 47' ' ' SER . 2.5 t -69.72 -33.12 72.04 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 120.87 0.367 . . . . 0.0 110.888 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.85 -38.68 73.17 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.254 1.021 . . . . 0.0 110.455 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -59.01 -42.77 90.93 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.818 0.847 . . . . 0.0 110.192 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -61.62 -42.51 98.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.709 1.256 . . . . 0.0 110.827 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -68.96 -44.73 72.37 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.316 0.647 . . . . 0.0 110.922 -174.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -58.13 -54.05 51.35 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.304 1.042 . . . . 0.0 111.61 176.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.59 -41.62 96.13 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.593 0.558 . . . . 0.0 110.641 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -57.56 -44.37 85.21 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.765 0.426 . . . . 0.0 111.657 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.387 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.451 ' N ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.1 m -83.22 156.79 22.98 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.85 0.86 . . . . 0.0 111.209 -176.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -125.51 128.95 48.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.678 1.191 . . . . 0.0 108.84 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -131.35 139.41 49.51 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.65 0.78 . . . . 0.0 111.033 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -131.59 111.72 11.97 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.429 1.492 . . . . 0.0 108.266 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 53.88 30.36 11.39 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.801 1.241 . . . . 0.0 112.044 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 92.07 -19.01 51.96 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.712 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.2 m -70.79 137.69 49.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.932 0.893 . . . . 0.0 110.665 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -89.41 117.24 28.19 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.41 109.34 13.68 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -79.24 -28.83 42.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.641 0.776 . . . . 0.0 111.457 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.65 -52.04 0.66 Allowed Glycine 0 C--N 1.348 1.201 0 C-N-CA 122.994 0.33 . . . . 0.0 113.327 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.0 mtp-105 -85.6 2.12 46.35 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.916 0.886 . . . . 0.0 113.315 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.521 ' HG3' HD22 ' A' ' 85' ' ' LEU . 1.1 pm0 -85.71 148.82 25.69 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 38.5 mt -100.4 151.35 37.53 Favored Pre-proline 0 C--N 1.316 -0.885 0 C-N-CA 124.957 1.303 . . . . 0.0 108.614 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.537 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 57.5 Cg_endo -65.51 -35.05 40.42 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 121.966 1.777 . . . . 0.0 111.232 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' A' ' 45' ' ' ARG . . . -60.26 -33.84 72.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.971 0.909 . . . . 0.0 111.151 173.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -73.8 -44.67 55.17 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.539 0.735 . . . . 0.0 110.72 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.521 HD22 ' HG3' ' A' ' 80' ' ' GLU . 26.5 mt -66.9 -24.53 66.12 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.217 0.607 . . . . 0.0 110.817 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 88.77 51.79 2.96 Favored Glycine 0 C--N 1.345 1.079 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -175.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.2 mtp -112.82 165.33 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.408 1.083 . . . . 0.0 109.946 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -153.6 166.45 32.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.142 0.977 . . . . 0.0 108.839 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.3 m -54.59 111.8 0.88 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.568 0.747 . . . . 0.0 110.052 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.98 -28.79 3.3 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.045 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.48 168.21 1.66 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.8 tp -130.26 109.04 10.47 Favored 'General case' 0 C--N 1.349 0.555 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -168.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 30' ' ' VAL . 38.7 mt -92.06 152.2 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 171.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -124.06 165.16 17.97 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 -178.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.578 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 14.8 t -137.06 133.61 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 93.8 m95 . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 124.319 1.048 . . . . 0.0 108.745 -170.901 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.557 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 3.2 pp0? . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.408 0.623 . . . . 0.0 109.803 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -116.06 150.41 37.34 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.03 1.332 . . . . 0.0 107.504 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -99.82 103.32 14.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.526 HD11 ' HB3' ' A' ' 91' ' ' ASP . 1.8 mm? -101.16 126.97 47.91 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -91.48 105.28 17.65 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.387 0.675 . . . . 0.0 109.768 -176.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.33 123.82 52.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.041 0.937 . . . . 0.0 108.695 -173.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -130.69 138.19 49.91 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.816 0.446 . . . . 0.0 110.491 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.608 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.347 1.154 0 O-C-N 123.684 0.615 . . . . 0.0 113.185 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.4 m . . . . . 0 C--O 1.237 0.417 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.5 tp -131.97 154.35 49.4 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 173.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.1 132.53 44.91 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 167.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -131.0 146.39 34.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 123.613 0.765 . . . . 0.0 109.521 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.3 p -90.86 105.94 18.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.493 ' HB3' HD22 ' A' ' 28' ' ' LEU . 66.6 tp -107.34 130.72 54.75 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.919 176.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.557 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 41.9 t -75.62 152.32 37.65 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.611 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 31.6 ptt180 -69.13 -13.38 62.39 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.479 0.712 . . . . 0.0 111.746 179.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -99.13 -23.67 15.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.919 0.888 . . . . 0.0 109.882 177.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 133.04 50.88 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.63 0.772 . . . . 0.0 110.305 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.471 ' O ' HG22 ' A' ' 51' ' ' THR . 6.1 Cg_exo -69.64 158.6 56.54 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.833 2.355 . . . . 0.0 113.271 178.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.3 mm? -58.35 -25.79 62.38 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.742 1.217 . . . . 0.0 112.04 177.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.402 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.51 -39.16 75.9 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.223 0.609 . . . . 0.0 112.387 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -72.38 -29.53 63.85 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 120.897 0.38 . . . . 0.0 110.778 -178.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -70.39 -41.45 72.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.037 0.935 . . . . 0.0 110.314 172.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.464 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 63.8 mtt -55.02 -49.72 70.85 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.994 0.918 . . . . 0.0 110.835 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 p -67.06 -38.35 85.65 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.972 1.42 . . . . 0.0 109.627 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -64.64 -48.79 73.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.024 0.53 . . . . 0.0 110.288 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -56.29 -59.08 5.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.088 0.955 . . . . 0.0 111.837 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 53' ' ' MET . 15.8 pt-20 -62.31 -31.64 72.28 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.027 0.83 . . . . 0.0 112.55 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -70.72 -46.42 63.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.434 0.294 . . . . 0.0 111.789 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.196 0 C-N-CA 123.55 0.74 . . . . 0.0 112.451 -173.602 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.453 ' N ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.058 0.456 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 160.27 14.76 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.289 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -124.68 131.79 53.44 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.011 0.924 . . . . 0.0 109.37 -177.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -134.06 116.92 16.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.388 1.075 . . . . 0.0 110.534 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -97.41 109.76 22.45 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.6 t70 51.8 40.57 28.01 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.052 0.93 . . . . 0.0 111.02 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 72.71 6.27 66.42 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 114.982 -1.008 . . . . 0.0 114.575 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -87.84 116.99 26.38 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.97 0.908 . . . . 0.0 109.57 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -67.16 113.84 5.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.425 0.453 . . . . 0.0 110.232 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -80.65 123.69 28.37 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.7 m -75.09 -30.12 60.82 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.768 0.827 . . . . 0.0 110.716 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.91 -38.32 2.27 Favored Glycine 0 C--N 1.345 1.034 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.219 -175.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -87.55 2.56 50.44 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -170.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.52 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -89.54 147.71 23.8 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 172.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.2 mt -97.21 158.08 33.84 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 125.119 1.368 . . . . 0.0 108.261 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.611 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 62.0 Cg_endo -66.29 -27.56 47.95 Favored 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 110.781 176.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.69 -37.12 81.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.594 0.757 . . . . 0.0 110.707 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -68.65 -41.33 79.5 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.789 0.835 . . . . 0.0 110.647 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.52 HD21 ' HG3' ' A' ' 80' ' ' GLU . 84.5 mt -75.54 -24.12 56.7 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.074 0.95 . . . . 0.0 112.17 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.99 58.56 3.18 Favored Glycine 0 C--N 1.346 1.091 0 O-C-N 123.371 0.419 . . . . 0.0 112.22 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.8 mtp -102.83 171.0 7.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.115 0.966 . . . . 0.0 110.079 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.4 tt0 -137.23 157.57 46.35 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.068 0.547 . . . . 0.0 110.876 -178.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.3 p -59.28 111.1 1.23 Allowed 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 168.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 94.8 42.23 3.9 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.889 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.526 ' HB3' HD11 ' A' ' 28' ' ' LEU . 2.4 t70 -97.53 -171.57 2.22 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 177.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 35.7 tp -137.03 135.48 37.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.261 0.625 . . . . 0.0 109.5 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.4 mt -127.34 148.92 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.66 154.36 39.48 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -173.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.608 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.8 t -133.7 121.93 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.3 m95 . . . . . 0 C--O 1.236 0.368 0 C-N-CA 124.407 1.083 . . . . 0.0 109.566 -172.923 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.434 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.426 0 CA-C-O 121.812 0.815 . . . . 0.0 111.563 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -116.77 151.01 37.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.698 1.599 . . . . 0.0 109.323 -177.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -103.06 109.78 21.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 171.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.479 HD22 ' HB3' ' A' ' 43' ' ' LEU . 1.1 mm? -112.24 139.63 47.62 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.3 mtp85 -92.76 112.83 24.93 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.493 0.717 . . . . 0.0 110.546 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.28 113.5 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.499 1.12 . . . . 0.0 108.665 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -126.29 133.59 51.37 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -172.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.56 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.873 0 O-C-N 123.718 0.636 . . . . 0.0 112.556 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.3 m . . . . . 0 C--O 1.237 0.439 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -139.85 142.38 36.59 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -133.71 136.61 44.77 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -140.2 151.71 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 123.919 0.887 . . . . 0.0 109.989 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -92.13 108.67 20.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.424 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.479 ' HB3' HD22 ' A' ' 28' ' ' LEU . 31.2 tp -105.21 131.47 52.64 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.531 1.132 . . . . 0.0 109.178 175.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 44.7 m -76.84 151.65 35.79 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.514 0.509 . . . . 0.0 109.654 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.563 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 12.8 ptm180 -67.53 -18.69 65.12 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.257 0.551 . . . . 0.0 110.949 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -92.92 -30.93 15.14 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.138 1.375 . . . . 0.0 109.77 -175.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.6 m -88.34 140.63 30.34 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.21 1.004 . . . . 0.0 110.35 -176.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.476 ' HA ' HD21 ' A' ' 81' ' ' LEU . 6.8 Cg_exo -67.78 157.66 60.76 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.221 2.614 . . . . 0.0 113.408 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.46 ' HB3' ' HE1' ' A' ' 53' ' ' MET . 3.9 mm? -51.79 -32.35 30.88 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.061 1.344 . . . . 0.0 112.068 173.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.453 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -58.88 -35.88 73.72 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.638 0.775 . . . . 0.0 112.593 -177.351 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.47 HG23 ' O ' ' A' ' 48' ' ' PRO . 4.3 t -67.7 -33.69 75.39 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.93 -40.78 68.52 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.532 1.133 . . . . 0.0 110.607 175.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.46 ' HE1' ' HB3' ' A' ' 49' ' ' LEU . 64.9 mtt -58.83 -46.33 87.92 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.072 0.949 . . . . 0.0 110.865 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 p -68.18 -28.06 66.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.48 1.112 . . . . 0.0 110.799 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -71.31 -47.7 55.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.323 0.649 . . . . 0.0 110.322 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.26 -58.83 5.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.38 1.072 . . . . 0.0 111.905 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 53' ' ' MET . 6.7 pt-20 -59.52 -31.04 69.02 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 124.018 0.823 . . . . 0.0 112.427 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.47 -43.06 70.56 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -174.968 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.441 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -93.3 158.69 15.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.424 0.69 . . . . 0.0 110.732 -175.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.431 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 48.1 m-85 -124.32 127.83 48.21 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.432 1.093 . . . . 0.0 109.375 -176.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.25 129.76 49.57 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.082 0.953 . . . . 0.0 110.195 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.485 ' HB3' HD21 ' A' ' 76' ' ' LEU . 51.6 t80 -108.02 109.41 20.86 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.77 27.08 16.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.557 1.143 . . . . 0.0 111.391 -172.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.55 -2.11 88.26 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.055 -0.521 . . . . 0.0 113.852 -175.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.8 m -79.01 122.56 26.34 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -67.87 117.64 10.02 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.485 HD21 ' HB3' ' A' ' 71' ' ' PHE . 21.5 mt -92.29 120.34 32.74 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.2 t -77.47 -23.02 50.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.264 0.626 . . . . 0.0 110.965 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.99 -38.64 2.99 Favored Glycine 0 C--N 1.344 0.991 0 C-N-CA 123.043 0.354 . . . . 0.0 113.286 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.7 mtp180 -76.41 -14.98 60.04 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.558 0.743 . . . . 0.0 112.849 -171.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.24 149.02 44.94 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 173.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 48' ' ' PRO . 21.8 mt -99.13 157.21 34.46 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 125.161 1.384 . . . . 0.0 107.302 176.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.563 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.1 Cg_endo -65.54 -17.02 56.3 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 121.466 1.444 . . . . 0.0 111.39 178.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.78 93.38 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.747 0.819 . . . . 0.0 111.006 170.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -68.01 -45.62 73.54 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.107 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 79.5 mt -74.24 -15.0 61.01 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.616 0.766 . . . . 0.0 112.561 -176.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.67 35.73 27.86 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.153 0.283 . . . . 0.0 112.991 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.496 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 60.5 mtp -90.22 166.4 13.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.169 0.988 . . . . 0.0 110.855 -177.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -153.81 166.38 33.07 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.3 t -61.51 112.05 2.05 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.888 0.475 . . . . 0.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 130.5 -27.63 3.92 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.814 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.418 ' HB2' HD13 ' A' ' 28' ' ' LEU . 1.8 m-20 -58.08 172.72 0.4 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.2 tp -133.83 113.94 12.8 Favored 'General case' 0 C--N 1.352 0.682 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.393 -163.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.418 HD12 ' HE3' ' A' ' 87' ' ' MET . 39.4 mt -100.39 149.17 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 172.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.431 ' O ' ' HA ' ' A' ' 69' ' ' PHE . 36.5 mt-10 -112.96 158.38 20.31 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -172.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.56 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.1 t -135.15 118.73 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.1 m95 . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 125.277 1.431 . . . . 0.0 109.033 -178.965 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 121.032 0.444 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 82.8 mt -91.55 129.67 37.5 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.587 -174.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -89.17 102.73 15.38 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.596 HD21 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mm? -106.19 122.02 45.35 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -89.79 124.36 34.59 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.328 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.83 117.17 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.223 1.009 . . . . 0.0 109.54 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -127.01 130.92 50.96 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.965 0.906 . . . . 0.0 108.579 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.473 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.339 0.698 0 O-C-N 123.753 0.658 . . . . 0.0 113.596 -173.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.241 0.627 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -131.2 137.47 48.97 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -132.01 141.57 49.3 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.056 0.455 . . . . 0.0 109.878 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.33 152.6 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.119 0.968 . . . . 0.0 109.84 178.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -91.71 110.78 22.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.596 ' HB3' HD21 ' A' ' 28' ' ' LEU . 32.2 tp -102.85 136.66 42.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.465 0.706 . . . . 0.0 109.824 176.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 34.0 t -76.29 143.88 40.62 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.521 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.1 ptm180 -60.58 -29.41 69.17 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.986 0.914 . . . . 0.0 112.835 -175.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -110.57 3.06 19.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.532 0.733 . . . . 0.0 111.977 -178.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 70.1 m -93.47 134.04 27.33 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 170.385 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.539 ' O ' HG23 ' A' ' 51' ' ' THR . 2.8 Cg_exo -65.95 155.69 68.21 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.753 2.302 . . . . 0.0 112.784 -176.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -53.54 -27.53 26.54 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.982 1.313 . . . . 0.0 112.322 176.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.492 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.69 -37.98 74.39 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.759 0.824 . . . . 0.0 112.949 179.555 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 48' ' ' PRO . 7.3 t -67.3 -33.31 75.02 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.348 0.594 . . . . 0.0 110.359 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.36 -41.06 66.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.961 1.304 . . . . 0.0 110.442 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.477 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.2 mtt -55.05 -44.03 74.34 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.93 0.892 . . . . 0.0 110.915 176.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -67.26 -35.38 79.39 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -71.53 -46.76 58.7 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.909 0.484 . . . . 0.0 110.777 -175.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -54.09 -57.46 11.0 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.811 0.845 . . . . 0.0 111.743 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.7 pt-20 -60.1 -31.83 70.41 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.894 0.746 . . . . 0.0 111.768 -177.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.51 -36.75 76.75 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 173.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -178.214 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 121.209 0.528 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 31.8 m -113.32 156.57 23.14 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.306 1.042 . . . . 0.0 109.803 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.497 ' CE1' HD21 ' A' ' 67' ' ' LEU . 38.9 m-85 -122.61 128.2 50.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.659 0.784 . . . . 0.0 110.041 -172.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.454 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 60.7 m-85 -127.44 139.32 52.9 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.868 0.867 . . . . 0.0 110.783 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -116.24 107.08 14.41 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 51.19 41.42 27.73 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 122.093 0.949 . . . . 0.0 111.244 -172.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.55 -8.22 66.02 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 115.032 -0.985 . . . . 0.0 114.949 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.8 m -74.51 115.58 14.21 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.225 0.61 . . . . 0.0 109.719 178.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.48 114.06 4.59 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.01 109.12 16.06 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.6 m -69.48 -28.11 65.79 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.089 0.955 . . . . 0.0 111.005 -176.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.52 -49.5 0.9 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.385 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -87.42 10.83 16.22 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.628 0.771 . . . . 0.0 112.967 -170.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 mp0 -83.87 148.13 27.14 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 173.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 30.3 mt -101.26 152.05 37.86 Favored Pre-proline 0 C--N 1.309 -1.182 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 176.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.521 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 59.1 Cg_endo -64.36 -35.66 49.14 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.687 1.591 . . . . 0.0 110.989 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.52 -30.55 70.25 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.164 0.586 . . . . 0.0 110.8 175.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -71.87 -45.16 62.31 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.805 0.842 . . . . 0.0 111.592 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.418 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 54.6 mt -69.91 -24.94 63.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.49 0.716 . . . . 0.0 111.487 -176.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.0 45.92 3.48 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 -173.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.418 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 63.3 mtp -104.76 163.97 12.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.158 0.983 . . . . 0.0 108.99 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -135.07 178.37 7.08 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 -176.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.0 p -74.19 19.22 0.13 Allowed 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -176.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.09 61.14 0.3 Allowed Glycine 0 C--N 1.344 0.985 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 172.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.457 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -111.12 -177.49 3.22 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.568 0.747 . . . . 0.0 109.399 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 37.6 tp -137.52 114.78 10.94 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 109.913 -167.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 43.1 mt -98.11 150.91 4.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 113.956 -1.474 . . . . 0.0 108.563 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 41.9 mt-10 -106.14 152.86 22.89 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 -175.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.473 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.6 t -130.63 109.44 16.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 92.1 m95 . . . . . 0 CA--C 1.533 0.293 0 C-N-CA 124.156 0.982 . . . . 0.0 109.835 -174.617 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 40.4 mt-30 . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.412 HD12 ' HB2' ' A' ' 82' ' ' PRO . 56.2 mt -107.84 129.27 55.08 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.187 1.395 . . . . 0.0 109.173 -177.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -84.25 103.12 13.18 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -112.27 132.49 54.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.034 0.534 . . . . 0.0 110.336 -175.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -91.2 110.59 21.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.169 0.987 . . . . 0.0 109.021 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HE2' ' A' ' 69' ' ' PHE . 2.2 t -105.78 124.72 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -177.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -135.5 145.14 46.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 118.099 0.409 . . . . 0.0 110.359 -173.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.525 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.348 1.225 0 O-C-N 123.374 0.421 . . . . 0.0 112.538 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 m . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 120.858 0.361 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.2 tp -138.3 127.39 24.16 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 167.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -103.17 113.03 26.18 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 175.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.95 151.17 23.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 123.828 0.851 . . . . 0.0 110.435 -172.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -92.49 109.23 20.62 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 171.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.434 ' HB2' HD11 ' A' ' 52' ' ' LEU . 23.6 tp -105.82 125.53 51.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.25 0.62 . . . . 0.0 109.381 172.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 58.6 m -73.18 144.34 46.87 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.484 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 26.4 ptt180 -62.54 -26.51 68.61 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.876 0.87 . . . . 0.0 112.398 -173.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -99.56 -11.7 20.78 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.783 0.833 . . . . 0.0 111.029 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.4 m -92.34 136.77 25.19 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 123.743 0.817 . . . . 0.0 109.381 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.539 ' O ' HG23 ' A' ' 51' ' ' THR . 3.7 Cg_exo -71.41 161.69 44.75 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.796 2.331 . . . . 0.0 113.781 -176.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.488 HD13 ' HE2' ' A' ' 87' ' ' MET . 3.8 mm? -53.83 -31.4 49.14 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 125.241 1.416 . . . . 0.0 112.242 175.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -32.71 72.42 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -70.18 -33.26 71.51 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 118.113 0.415 . . . . 0.0 111.036 174.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.434 HD11 ' HB2' ' A' ' 43' ' ' LEU . 6.3 tt -68.94 -39.31 79.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.1 0.96 . . . . 0.0 110.126 173.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.3 mtt -59.01 -42.73 90.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.327 1.051 . . . . 0.0 110.09 175.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 t -68.02 -40.28 82.97 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.259 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -66.63 -48.2 70.2 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 120.952 0.406 . . . . 0.0 110.569 -174.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -55.18 -53.46 55.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.005 1.322 . . . . 0.0 112.213 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.83 -46.62 84.26 Favored 'General case' 0 CA--C 1.558 1.253 0 O-C-N 124.154 0.908 . . . . 0.0 110.908 -179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.38 -45.54 84.36 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.241 0.616 . . . . 0.0 111.994 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.079 0 C-N-CA 124.074 0.95 . . . . 0.0 112.935 -178.087 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.577 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 21.1 m -76.95 144.46 38.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.407 0.283 . . . . 0.0 110.892 -174.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.443 ' HE2' HG11 ' A' ' 30' ' ' VAL . 49.2 m-85 -120.26 125.85 49.13 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.894 0.877 . . . . 0.0 109.892 179.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -125.13 133.08 52.97 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.266 1.026 . . . . 0.0 110.094 177.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.438 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.1 t80 -124.46 114.56 19.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.219 1.008 . . . . 0.0 108.538 174.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.14 27.83 15.58 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.593 1.157 . . . . 0.0 111.368 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.84 -8.17 76.98 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.314 -0.857 . . . . 0.0 113.828 -177.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 96.7 m -73.76 119.86 18.56 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.114 0.566 . . . . 0.0 110.272 176.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -68.07 113.5 5.79 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.438 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.3 mt -82.03 116.84 21.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.7 m -73.37 -31.65 64.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.656 0.782 . . . . 0.0 111.155 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.8 -48.65 0.96 Allowed Glycine 0 C--N 1.343 0.923 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.296 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.5 mtp85 -86.45 9.72 17.34 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -169.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -84.66 147.54 26.89 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 166.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.16 161.96 26.41 Favored Pre-proline 0 C--N 1.313 -0.981 0 C-N-CA 124.541 1.136 . . . . 0.0 108.566 174.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.484 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 60.8 Cg_endo -66.23 -30.29 46.07 Favored 'Trans proline' 0 C--N 1.368 1.581 0 C-N-CA 121.429 1.419 . . . . 0.0 110.812 174.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.4 80.12 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.053 0.941 . . . . 0.0 111.032 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -69.54 -48.78 59.25 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.016 0.927 . . . . 0.0 111.841 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.453 HD13 ' HE1' ' A' ' 87' ' ' MET . 87.9 mt -71.83 -20.8 61.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.433 0.693 . . . . 0.0 111.397 -177.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.92 15.66 51.29 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.455 0.472 . . . . 0.0 112.456 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.488 ' HE2' HD13 ' A' ' 49' ' ' LEU . 57.9 mtm -76.54 160.09 29.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.326 0.65 . . . . 0.0 110.869 177.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -160.82 166.64 28.24 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.712 1.205 . . . . 0.0 107.981 -170.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.1 m -61.04 106.08 0.55 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 118.029 0.377 . . . . 0.0 110.519 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 136.56 -32.73 2.43 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.032 -0.531 . . . . 0.0 113.219 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.7 170.81 0.07 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.4 tp -132.16 109.28 9.85 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -168.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 51.6 mt -95.94 147.96 5.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.567 -1.272 . . . . 0.0 107.567 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -124.06 161.76 24.89 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -172.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.525 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.7 t -140.06 128.04 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.844 0.858 . . . . 0.0 110.418 -169.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.577 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 55.9 m95 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.5 mp -110.23 147.95 32.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.23 1.412 . . . . 0.0 108.431 -172.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -102.14 104.73 15.35 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.502 HD22 ' HB3' ' A' ' 43' ' ' LEU . 1.9 mm? -104.65 135.85 45.28 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -175.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -90.59 128.94 36.75 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.94 123.21 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -172.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -134.01 141.06 47.09 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.016 0.371 . . . . 0.0 110.564 -173.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.633 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.894 0 O-C-N 123.871 0.732 . . . . 0.0 112.323 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.0 m . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 121.143 0.497 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.3 tp -136.3 136.29 39.63 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -119.54 122.85 42.55 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.0 p -128.76 149.45 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 123.935 0.894 . . . . 0.0 110.562 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 p -92.93 108.94 20.39 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.502 ' HB3' HD22 ' A' ' 28' ' ' LEU . 28.1 tp -103.91 134.33 47.38 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.456 1.102 . . . . 0.0 109.494 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.9 t -79.0 145.72 33.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.601 ' HB2' ' HB3' ' A' ' 83' ' ' ALA . 33.6 ptt180 -68.41 -13.51 62.35 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.753 0.421 . . . . 0.0 112.041 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -97.65 -21.71 16.88 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.115 0.966 . . . . 0.0 109.91 177.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.6 m -88.38 134.75 33.85 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.489 ' O ' HG22 ' A' ' 51' ' ' THR . 5.4 Cg_exo -71.11 163.39 39.36 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 122.71 2.273 . . . . 0.0 112.968 178.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.475 ' O ' ' HG3' ' A' ' 53' ' ' MET . 2.6 mm? -60.65 -22.94 64.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.479 1.112 . . . . 0.0 111.655 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -56.94 -38.29 72.72 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.302 0.641 . . . . 0.0 112.166 178.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.6 t -71.0 -28.77 64.66 Favored 'General case' 0 C--N 1.355 0.84 0 CA-C-O 120.862 0.363 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -74.58 -41.11 61.08 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 110.359 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -55.43 -48.93 73.68 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.785 0.834 . . . . 0.0 111.051 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.7 p -70.41 -33.63 71.58 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 113.868 -1.515 . . . . 0.0 109.61 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.11 -52.7 46.25 Favored 'General case' 0 C--N 1.354 0.787 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -55.84 -60.7 3.09 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 123.829 0.852 . . . . 0.0 111.506 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.43 -38.11 79.81 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.792 0.682 . . . . 0.0 112.749 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.66 -29.07 61.11 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 123.087 0.555 . . . . 0.0 111.804 -179.439 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.457 ' N ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 110.998 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 71.1 m -91.58 163.51 14.1 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.99 -178.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 35.4 m-85 -129.02 130.45 46.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.319 1.048 . . . . 0.0 108.968 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -130.44 129.02 42.46 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.726 0.81 . . . . 0.0 111.485 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -119.2 111.99 18.93 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.632 1.573 . . . . 0.0 107.673 172.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 51.56 40.69 27.61 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.065 0.936 . . . . 0.0 112.011 -177.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 81.54 -19.28 9.14 Favored Glycine 0 N--CA 1.478 1.457 0 CA-C-N 115.012 -0.994 . . . . 0.0 114.589 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.7 m -71.23 116.03 11.07 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.458 0.703 . . . . 0.0 109.919 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -70.87 113.69 8.18 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.33 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.22 116.23 13.51 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 m -74.06 -35.68 64.29 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.153 0.981 . . . . 0.0 111.886 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.15 -56.25 0.51 Allowed Glycine 0 C--N 1.347 1.165 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.925 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -89.77 10.29 24.06 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -167.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.476 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.9 OUTLIER -86.43 148.46 25.55 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 175.415 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.1 mt -101.39 149.84 36.69 Favored Pre-proline 0 C--N 1.315 -0.92 0 C-N-CA 124.993 1.317 . . . . 0.0 109.18 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.564 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 56.7 Cg_endo -66.13 -24.79 51.4 Favored 'Trans proline' 0 C--N 1.377 2.073 0 C-N-CA 122.07 1.846 . . . . 0.0 111.44 179.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.601 ' HB3' ' HB2' ' A' ' 45' ' ' ARG . . . -60.64 -47.45 86.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.813 0.845 . . . . 0.0 110.267 170.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -71.17 -32.68 69.2 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.808 -175.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.476 HD21 ' HG3' ' A' ' 80' ' ' GLU . 72.9 mt -75.63 -23.04 56.3 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.551 0.74 . . . . 0.0 111.175 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.41 52.62 4.72 Favored Glycine 0 C--N 1.344 1.026 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 -175.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 71.5 mtp -97.58 174.87 6.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.678 0.791 . . . . 0.0 110.148 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.489 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 38.6 tt0 -133.99 155.8 49.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.241 0.616 . . . . 0.0 110.576 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 p -63.05 115.19 4.21 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 165.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.54 52.63 3.3 Favored Glycine 0 C--N 1.342 0.879 0 N-CA-C 111.613 -0.595 . . . . 0.0 111.613 -169.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t70 -110.07 -159.46 0.68 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.4 tp -142.93 143.54 32.04 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.865 0.841 . . . . 0.0 110.576 -175.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.2 mt -139.3 150.78 22.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 C-N-CA 126.472 1.909 . . . . 0.0 106.734 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -121.68 168.04 12.24 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 109.625 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.633 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 44.0 t -142.41 105.3 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 -174.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 94.6 m95 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 121.736 0.779 . . . . 0.0 109.636 -175.743 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 . . . . . 0 C--O 1.24 0.565 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.471 HD12 ' HB2' ' A' ' 82' ' ' PRO . 77.2 mt -108.21 125.98 52.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.886 1.274 . . . . 0.0 109.53 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.53 102.92 14.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 42.4 mt -110.39 131.44 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.08 0.552 . . . . 0.0 109.75 -173.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.409 ' O ' HD13 ' A' ' 92' ' ' LEU . 64.4 mtt85 -94.3 109.94 21.72 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.518 0.727 . . . . 0.0 109.213 -178.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -101.13 127.63 54.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.427 ' HG2' HG21 ' A' ' 38' ' ' THR . 70.8 mt-30 -134.45 153.1 52.1 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -177.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.503 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 N--CA 1.463 0.435 0 O-C-N 123.399 0.437 . . . . 0.0 112.766 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.427 HG21 ' HG2' ' A' ' 31' ' ' GLN . 90.7 m . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 tp -142.59 144.66 32.96 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.585 1.154 . . . . 0.0 108.158 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -120.22 115.68 24.09 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.42 150.05 27.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 123.936 0.894 . . . . 0.0 110.134 -170.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.7 m -92.21 108.57 20.05 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.4 ' HB2' HD11 ' A' ' 52' ' ' LEU . 26.7 tp -105.54 123.59 48.15 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.216 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.2 m -72.87 147.71 45.11 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -177.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.34 -27.69 68.68 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.955 0.902 . . . . 0.0 112.482 -171.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -101.07 -12.05 19.15 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.549 0.739 . . . . 0.0 111.006 -178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.417 ' HB3' HG21 ' A' ' 51' ' ' THR . 67.7 m -83.82 134.8 43.66 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 123.293 0.637 . . . . 0.0 109.819 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.57 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 2.7 Cg_exo -67.78 158.01 59.19 Favored 'Trans proline' 0 C--N 1.368 1.554 0 C-N-CA 122.707 2.271 . . . . 0.0 113.122 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.591 HD13 ' HE2' ' A' ' 87' ' ' MET . 4.0 mm? -54.24 -30.78 51.43 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.782 1.233 . . . . 0.0 111.974 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.57 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.57 -34.37 69.13 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.468 HG23 ' O ' ' A' ' 48' ' ' PRO . 2.8 t -71.77 -33.01 68.27 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 120.862 0.363 . . . . 0.0 110.936 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.4 HD11 ' HB2' ' A' ' 43' ' ' LEU . 4.3 tt -68.43 -41.76 79.89 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.539 1.135 . . . . 0.0 110.356 173.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.5 -48.31 81.22 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.189 0.995 . . . . 0.0 109.74 176.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 t -63.1 -38.73 92.36 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 113.998 -1.455 . . . . 0.0 110.901 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -63.02 -50.1 72.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.004 0.522 . . . . 0.0 110.06 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.471 ' CE2' HG21 ' A' ' 95' ' ' VAL . 48.2 t80 -55.82 -57.03 13.74 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.558 1.143 . . . . 0.0 112.389 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -65.77 -42.5 90.77 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.374 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -63.8 -38.22 90.28 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 123.753 0.821 . . . . 0.0 113.098 -179.965 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.424 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.762 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.416 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 17.4 m -77.23 153.06 34.4 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.859 0.463 . . . . 0.0 111.089 -176.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -125.61 125.61 43.41 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.084 0.954 . . . . 0.0 109.317 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -124.86 143.67 50.71 Favored 'General case' 0 C--O 1.212 -0.881 0 C-N-CA 124.001 0.92 . . . . 0.0 109.973 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -118.91 105.48 11.53 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.6 t70 55.76 28.33 12.11 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 124.145 0.978 . . . . 0.0 111.691 -170.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.04 1.5 79.38 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.692 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.3 m -79.1 119.62 22.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.474 0.71 . . . . 0.0 109.413 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.65 114.01 8.31 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.6 mt -83.4 126.69 33.0 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -83.38 -34.44 25.57 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.507 0.723 . . . . 0.0 111.845 -175.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.99 -60.87 0.56 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.57 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 57.3 mtp85 -84.02 5.96 23.84 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -169.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.467 ' HG3' HD22 ' A' ' 85' ' ' LEU . 2.6 pm0 -76.31 147.86 37.9 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 170.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -100.1 162.7 20.15 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 124.424 1.09 . . . . 0.0 108.883 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.471 ' HB2' HD12 ' A' ' 26' ' ' LEU . 62.9 Cg_endo -66.8 -23.51 48.05 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 121.606 1.537 . . . . 0.0 111.01 174.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.97 -32.95 73.72 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.919 0.887 . . . . 0.0 111.244 171.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.61 -47.63 21.73 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.723 0.809 . . . . 0.0 110.922 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.467 HD22 ' HG3' ' A' ' 80' ' ' GLU . 77.3 mt -72.13 -15.29 61.98 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.32 0.648 . . . . 0.0 111.404 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.36 28.36 55.82 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.529 0.518 . . . . 0.0 112.534 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.591 ' HE2' HD13 ' A' ' 49' ' ' LEU . 66.2 mtm -84.36 168.21 15.8 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.72 0.808 . . . . 0.0 111.593 177.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HA ' HD11 ' A' ' 26' ' ' LEU . 40.2 tt0 -155.87 169.3 24.73 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.715 1.206 . . . . 0.0 108.367 -177.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 m -57.39 112.25 1.35 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.26 0.624 . . . . 0.0 110.911 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 122.71 -14.21 8.6 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-O 119.624 -0.542 . . . . 0.0 113.629 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.49 170.46 1.02 Allowed 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 175.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 29' ' ' ARG . 43.9 tp -132.61 111.7 11.43 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.877 -169.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 56.8 mt -100.63 152.31 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.525 1.13 . . . . 0.0 108.182 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -115.45 163.33 15.88 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.687 1.195 . . . . 0.0 108.741 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.503 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 22.3 t -136.97 110.1 8.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 124.465 1.106 . . . . 0.0 108.994 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.8 m95 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.792 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.572 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 10.4 pt20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.406 HD12 ' HB2' ' A' ' 82' ' ' PRO . 53.5 mt -114.29 128.91 56.58 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.47 1.508 . . . . 0.0 109.448 177.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.23 105.17 17.28 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.05 135.66 52.41 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.822 0.849 . . . . 0.0 109.831 -169.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.59 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 81.6 mtt180 -95.38 111.99 23.78 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.823 0.849 . . . . 0.0 110.313 -177.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.17 129.97 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.987 0.915 . . . . 0.0 109.874 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -131.05 146.67 52.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.76 0.824 . . . . 0.0 108.923 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.607 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 N--CA 1.466 0.693 0 C-N-CA 121.603 -0.332 . . . . 0.0 113.138 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 120.768 0.318 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -137.12 151.15 48.52 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.869 1.268 . . . . 0.0 107.582 173.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.59 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.0 pt-20 -131.3 126.35 35.13 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -135.23 147.72 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.798 -172.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.8 m -92.77 110.81 22.26 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.57 0.748 . . . . 0.0 109.042 -178.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 32.7 tp -110.26 130.79 55.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.328 1.051 . . . . 0.0 109.594 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.572 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 20.8 t -75.41 145.76 41.32 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.58 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.63 -21.36 65.62 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -172.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -106.17 -7.86 17.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.905 0.882 . . . . 0.0 111.849 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.9 m -90.37 134.54 30.97 Favored Pre-proline 0 CA--C 1.543 0.689 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.522 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 8.1 Cg_exo -63.5 155.35 63.09 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.899 2.4 . . . . 0.0 113.403 -178.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.0 mm? -53.28 -30.36 38.2 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 124.561 1.145 . . . . 0.0 111.874 173.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.522 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.85 -37.05 73.17 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.077 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.492 HG21 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -68.52 -33.47 74.17 Favored 'General case' 0 CA--C 1.561 1.367 0 CA-C-O 121.053 0.454 . . . . 0.0 110.759 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 tt -70.61 -38.33 73.97 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.718 1.207 . . . . 0.0 110.177 173.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 62.2 mtt -60.5 -40.02 89.85 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.212 1.005 . . . . 0.0 111.155 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -65.49 -38.44 89.75 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.477 1.111 . . . . 0.0 110.182 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -67.33 -47.55 70.16 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.611 0.364 . . . . 0.0 110.409 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.5 -55.83 27.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.406 0.682 . . . . 0.0 111.677 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.52 -38.15 88.85 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 123.674 0.609 . . . . 0.0 112.149 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -66.81 -47.75 71.07 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.569 0.348 . . . . 0.0 111.612 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.052 0 C-N-CA 124.113 0.965 . . . . 0.0 112.185 -177.571 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.451 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.621 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.497 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 74.9 m -99.39 175.08 5.98 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.498 0.719 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -141.51 139.03 33.18 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.448 1.099 . . . . 0.0 109.553 -163.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -123.28 143.45 50.05 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.0 0.92 . . . . 0.0 110.664 174.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.51 ' HB3' HD21 ' A' ' 76' ' ' LEU . 66.4 t80 -129.6 106.12 8.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 171.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.12 26.94 16.8 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.445 1.098 . . . . 0.0 110.761 -170.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 90.55 -13.12 66.35 Favored Glycine 0 C--N 1.349 1.278 0 CA-C-N 115.635 -0.712 . . . . 0.0 113.595 -176.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.6 m -68.5 126.68 30.42 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.444 0.698 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.497 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 21.7 tptm -68.85 113.2 6.06 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 123.714 0.634 . . . . 0.0 109.896 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' A' ' 71' ' ' PHE . 23.5 mt -88.13 111.4 21.54 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 174.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.9 t -80.58 -18.44 48.28 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.987 0.915 . . . . 0.0 111.04 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.38 -39.5 2.49 Favored Glycine 0 C--N 1.347 1.159 0 C-N-CA 123.094 0.378 . . . . 0.0 113.295 177.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -81.88 1.57 34.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.261 0.624 . . . . 0.0 112.0 -173.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -80.41 148.68 30.46 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 48' ' ' PRO . 39.5 mt -101.67 153.38 37.95 Favored Pre-proline 0 C--N 1.306 -1.288 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 174.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.58 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.0 Cg_endo -66.81 -22.19 49.75 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.783 1.656 . . . . 0.0 111.354 176.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.81 98.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.669 0.787 . . . . 0.0 110.979 168.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -71.86 -45.49 61.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.925 0.89 . . . . 0.0 110.999 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.8 mt -75.8 -11.23 59.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.691 0.796 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.82 60.87 Favored Glycine 0 C--N 1.35 1.351 0 CA-C-N 116.946 -0.115 . . . . 0.0 113.238 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' MET . . . . . 0.424 ' HE2' HD12 ' A' ' 49' ' ' LEU . 61.2 mtt -73.0 161.85 30.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.022 0.929 . . . . 0.0 111.365 177.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -149.31 160.5 43.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.122 1.369 . . . . 0.0 107.696 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.9 t -60.07 111.74 1.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 176.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.65 -28.43 3.98 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-O 119.498 -0.612 . . . . 0.0 112.819 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.92 170.95 0.07 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 tp -132.55 109.58 9.87 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.812 -167.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.8 mt -96.41 152.79 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.235 1.014 . . . . 0.0 108.663 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -124.3 163.02 22.55 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -173.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.607 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 75.7 t -142.13 112.86 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 123.832 0.853 . . . . 0.0 109.231 -175.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.9 p-90 . . . . . 0 CA--C 1.537 0.443 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 172.391 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 24.3 p . . . . . 0 CA--C 1.551 0.997 0 CA-C-O 119.871 -0.109 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -141.17 -45.0 0.38 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.352 175.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.8 p -108.12 79.76 1.3 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 168.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.429 ' O ' ' HD2' ' A' ' 45' ' ' ARG . 6.4 m -100.76 115.22 29.79 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.742 -170.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -66.06 -52.37 49.56 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.217 0.607 . . . . 0.0 109.453 176.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -130.41 154.97 47.16 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.012 0.925 . . . . 0.0 108.69 172.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.533 HD11 ' HB2' ' A' ' 82' ' ' PRO . 71.4 mt -106.03 126.67 52.47 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.599 1.16 . . . . 0.0 109.072 -177.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -88.53 102.16 14.65 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 54.6 mt -109.04 129.4 55.46 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.851 0.861 . . . . 0.0 109.581 -171.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.631 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 58.9 mtt180 -87.64 105.86 17.63 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -99.76 114.22 37.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -137.05 145.51 44.11 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.564 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -86.55 174.53 46.72 Favored Glycine 0 C--N 1.339 0.73 0 O-C-N 123.423 0.452 . . . . 0.0 113.588 -173.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -44.64 -32.1 1.36 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.362 1.465 . . . . 0.0 112.697 166.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -91.15 135.82 33.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.222 1.009 . . . . 0.0 108.585 173.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.13 -20.28 62.34 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 117.925 0.329 . . . . 0.0 111.035 175.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -69.3 -34.55 74.87 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.641 0.777 . . . . 0.0 110.178 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -74.32 118.53 17.38 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 91.3 m -159.0 113.53 2.45 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -156.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.1 tp -143.24 153.58 42.96 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.002 0.365 . . . . 0.0 110.218 169.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.631 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 12.4 pt-20 -133.78 133.97 42.34 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 164.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -142.05 153.98 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 123.61 0.764 . . . . 0.0 109.785 -174.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.6 m -93.26 107.28 19.13 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.405 ' HB2' HD11 ' A' ' 52' ' ' LEU . 26.6 tp -95.13 128.86 42.3 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.1 t -72.48 141.44 48.57 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HD2' ' O ' ' A' ' 23' ' ' SER . 14.4 ptm180 -62.42 -28.53 69.86 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.18 0.592 . . . . 0.0 112.156 -171.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -91.09 -18.09 25.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.909 0.884 . . . . 0.0 111.524 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -94.05 129.11 38.58 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 123.525 0.73 . . . . 0.0 109.44 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.468 ' O ' HG21 ' A' ' 51' ' ' THR . 8.4 Cg_endo -67.12 161.98 40.37 Favored 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.583 2.188 . . . . 0.0 114.174 -175.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.45 -30.32 40.1 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 125.496 1.519 . . . . 0.0 112.207 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -38.39 72.84 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.468 HG21 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -69.37 -28.68 66.41 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.883 179.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.405 HD11 ' HB2' ' A' ' 43' ' ' LEU . 4.6 tt -74.37 -39.08 62.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.143 0.977 . . . . 0.0 110.268 172.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.479 ' HE3' ' HB2' ' A' ' 69' ' ' PHE . 64.3 mtt -60.54 -42.37 96.4 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.992 0.917 . . . . 0.0 111.213 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 p -71.27 -37.27 71.9 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -65.23 -48.81 71.99 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.132 0.573 . . . . 0.0 110.429 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -53.15 -57.46 10.39 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.58 1.552 . . . . 0.0 112.235 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -60.04 -41.19 91.73 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.779 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.433 ' HG2' ' HG ' ' A' ' 63' ' ' SER . 50.2 mt-10 -61.83 -40.58 95.78 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 178.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.83 80.29 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.632 0.773 . . . . 0.0 112.589 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 69.8 mtm -107.71 27.29 9.33 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.235 0.614 . . . . 0.0 111.949 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 49.05 36.11 20.23 Favored Glycine 0 CA--C 1.541 1.66 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.97 18.62 6.44 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 124.072 0.949 . . . . 0.0 110.553 168.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.433 ' HG ' ' HG2' ' A' ' 58' ' ' GLU . 17.0 m -56.19 99.28 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.861 0.864 . . . . 0.0 111.256 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.73 -48.37 0.95 Allowed Glycine 0 C--N 1.345 1.057 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -84.66 77.55 10.03 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -80.14 139.47 36.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.573 -170.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.414 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -111.23 159.37 17.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.783 1.233 . . . . 0.0 109.618 -175.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -78.59 155.37 29.66 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.431 0.692 . . . . 0.0 111.691 -177.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.479 ' HB2' ' HE3' ' A' ' 53' ' ' MET . 44.9 m-85 -131.58 130.89 42.81 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.165 0.986 . . . . 0.0 109.582 -178.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -128.53 146.66 50.77 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.288 1.035 . . . . 0.0 110.756 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.554 ' HB3' HD21 ' A' ' 76' ' ' LEU . 11.7 t80 -142.93 119.69 11.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.638 1.175 . . . . 0.0 108.565 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.0 t70 57.2 32.64 22.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.325 1.05 . . . . 0.0 111.042 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.13 -17.38 28.18 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.441 -0.799 . . . . 0.0 113.655 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 63.4 m -73.37 123.8 24.51 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 123.902 0.881 . . . . 0.0 110.572 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -70.32 114.24 8.26 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.554 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.7 mt -81.1 112.88 18.87 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 176.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.5 t -76.36 -21.77 55.68 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.55 0.74 . . . . 0.0 110.969 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.05 -31.84 6.07 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.49 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -91.75 9.73 31.35 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.09 0.956 . . . . 0.0 111.959 -172.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.425 ' HG3' HD23 ' A' ' 85' ' ' LEU . 2.0 pm0 -93.92 148.64 21.95 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 166.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 mt -94.69 155.83 38.98 Favored Pre-proline 0 C--N 1.314 -0.972 0 C-N-CA 125.213 1.405 . . . . 0.0 108.36 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.533 ' HB2' HD11 ' A' ' 26' ' ' LEU . 63.1 Cg_endo -67.18 -36.14 22.48 Favored 'Trans proline' 0 C--N 1.368 1.603 0 C-N-CA 121.575 1.516 . . . . 0.0 111.089 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -27.51 66.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.477 0.711 . . . . 0.0 111.184 174.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.05 -43.43 71.25 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.635 0.774 . . . . 0.0 110.844 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.425 HD23 ' HG3' ' A' ' 80' ' ' GLU . 83.9 mt -71.88 -21.46 61.65 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.732 0.813 . . . . 0.0 111.211 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.21 42.6 7.43 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 111.768 -0.533 . . . . 0.0 111.768 -178.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.403 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 73.9 mtp -95.55 165.11 12.5 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.92 0.888 . . . . 0.0 110.539 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.7 tp10 -147.8 162.46 39.17 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.409 0.684 . . . . 0.0 109.734 -177.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 p -59.64 119.87 8.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.718 0.807 . . . . 0.0 110.996 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.19 36.07 4.8 Favored Glycine 0 C--N 1.341 0.861 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.43 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t0 -98.38 -172.08 2.26 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.8 tp -142.43 109.91 5.71 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.7 mt -94.41 148.5 4.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 167.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -119.72 156.82 29.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.564 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 39.5 t -137.76 136.93 45.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -175.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -135.19 135.42 41.01 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.998 0.919 . . . . 0.0 108.829 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.206 0 CA-C-O 118.716 -1.047 . . . . 0.0 112.02 -177.753 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.62 -45.99 0.41 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.716 0.406 . . . . 0.0 111.5 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 59.2 p -110.95 78.94 1.15 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -103.51 67.35 0.91 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 155.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -83.12 -60.21 2.22 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 173.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -129.76 154.55 47.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.47 178.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 7.8 mp -98.79 109.15 21.95 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.131 -176.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -81.49 102.91 10.86 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.472 HD21 ' HB2' ' A' ' 91' ' ' ASP . 39.8 mt -108.7 135.84 49.27 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -174.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -91.84 130.02 37.69 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -121.89 117.84 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -132.1 139.44 48.48 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -172.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.433 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -91.29 -176.35 43.41 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HZ1' ' HB2' ' A' ' 33' ' ' LYS . 10.2 mtmp? -70.65 20.49 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 173.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -158.08 145.88 18.46 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.242 1.017 . . . . 0.0 108.963 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -65.78 -21.16 66.48 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.507 0.723 . . . . 0.0 111.672 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -56.27 -38.19 70.84 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.143 0.977 . . . . 0.0 110.299 172.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.5 ' HG3' ' HG2' ' A' ' 60' ' ' MET . 2.4 mp0 -97.94 81.98 2.93 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.442 172.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.4 m -125.47 120.15 30.17 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.809 -0.557 . . . . 0.0 110.404 163.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.2 tp -131.88 154.32 49.32 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.008 0.923 . . . . 0.0 108.634 176.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -132.49 134.11 44.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 162.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.68 149.76 33.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 124.194 0.998 . . . . 0.0 109.637 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.5 m -91.78 108.34 19.85 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.1 tp -96.32 131.13 43.16 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.04 0.936 . . . . 0.0 109.611 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.3 m -78.81 138.11 38.03 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.7 ptm180 -63.21 -23.83 67.6 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -175.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.08 -18.71 31.65 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.87 0.468 . . . . 0.0 110.533 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -92.28 134.19 28.74 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.168 0.987 . . . . 0.0 109.764 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.458 ' O ' HG21 ' A' ' 51' ' ' THR . 1.2 Cg_endo -70.43 164.92 33.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.558 2.172 . . . . 0.0 113.06 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -58.58 -24.63 61.26 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 111.921 178.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -34.61 71.56 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.453 0.701 . . . . 0.0 111.981 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.458 HG21 ' O ' ' A' ' 48' ' ' PRO . 7.4 t -74.47 -31.85 62.38 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-O 120.812 0.339 . . . . 0.0 110.548 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -67.26 -42.11 84.45 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.547 1.139 . . . . 0.0 110.181 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 61.8 mtt -57.65 -47.24 82.8 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.12 0.968 . . . . 0.0 110.476 172.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 m -65.01 -30.47 71.46 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.679 1.237 . . . . 0.0 110.062 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -70.66 -56.6 6.08 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.79 -60.99 2.67 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.684 1.194 . . . . 0.0 112.521 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.3 pt-20 -60.71 -36.81 79.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -74.35 -34.76 63.48 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.69 -49.34 14.69 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.528 0.731 . . . . 0.0 111.011 -176.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.5 ' HG2' ' HG3' ' A' ' 37' ' ' GLN . 51.4 tpp -73.66 -14.5 61.17 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.045 -173.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 16.67 25.37 Favored Glycine 0 C--N 1.353 1.519 0 O-C-N 122.448 -0.158 . . . . 0.0 113.419 174.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -91.12 33.52 0.96 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.161 0.984 . . . . 0.0 110.299 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 m -74.06 103.22 4.45 Favored 'General case' 0 C--O 1.243 0.721 0 C-N-CA 123.639 0.776 . . . . 0.0 110.28 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 113.75 -3.73 24.49 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.539 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -139.53 105.05 5.09 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.914 0.886 . . . . 0.0 109.379 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -128.62 163.76 24.35 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.157 0.983 . . . . 0.0 109.817 -177.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.3 m -82.1 148.58 28.47 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.409 0.683 . . . . 0.0 109.665 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.448 ' HB3' HD22 ' A' ' 76' ' ' LEU . 45.1 m-85 -122.82 128.85 50.96 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -129.83 127.54 40.48 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.142 0.496 . . . . 0.0 111.714 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -122.45 106.95 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 107.86 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.2 t70 49.32 47.92 21.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.583 1.153 . . . . 0.0 111.485 -174.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 82.37 -22.34 6.37 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 114.778 -1.101 . . . . 0.0 114.212 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 m -71.21 111.92 6.93 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.324 0.65 . . . . 0.0 110.097 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -68.87 114.13 6.92 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.448 HD22 ' HB3' ' A' ' 69' ' ' PHE . 1.1 mm? -75.27 108.22 7.89 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 176.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.5 m -72.52 -29.18 63.37 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.13 0.972 . . . . 0.0 111.839 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.91 -58.13 0.58 Allowed Glycine 0 C--N 1.345 1.068 0 CA-C-N 116.687 -0.233 . . . . 0.0 113.116 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -88.74 10.58 20.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.737 0.815 . . . . 0.0 112.894 -166.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.533 ' HG3' HD23 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -86.35 149.1 25.27 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 170.403 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.5 mt -98.43 151.47 37.49 Favored Pre-proline 0 C--N 1.314 -0.976 0 C-N-CA 125.13 1.372 . . . . 0.0 108.975 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.546 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 40.0 Cg_endo -64.71 -36.1 43.0 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 121.829 1.686 . . . . 0.0 111.498 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.19 81.93 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.427 0.691 . . . . 0.0 111.151 173.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.49 -34.24 76.73 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.877 0.871 . . . . 0.0 111.322 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.533 HD23 ' HG3' ' A' ' 80' ' ' GLU . 56.6 mt -80.77 -23.4 39.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.726 0.811 . . . . 0.0 111.79 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.45 22.85 25.63 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.7 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.478 ' HE3' HD11 ' A' ' 49' ' ' LEU . 52.7 mtt -74.28 168.95 18.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.169 0.988 . . . . 0.0 111.093 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -154.57 174.04 15.49 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 28.5 p -62.61 13.97 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.66 63.68 0.3 Allowed Glycine 0 C--N 1.347 1.145 0 CA-C-N 118.61 0.641 . . . . 0.0 111.614 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.472 ' HB2' HD21 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -110.58 -171.73 1.89 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.601 0.76 . . . . 0.0 110.318 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.0 tp -139.46 144.63 38.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.414 0.686 . . . . 0.0 109.435 -173.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.1 mt -134.09 136.23 53.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -125.12 100.97 6.8 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -170.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.433 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 34.0 t -71.66 128.54 34.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.788 174.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -101.1 94.0 5.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 169.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.79 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.062 -177.357 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.551 HG23 HE21 ' A' ' 24' ' ' GLN . 55.8 m . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.09 -27.25 13.64 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.462 0.705 . . . . 0.0 111.231 177.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.1 p -70.61 121.08 17.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.58 0.752 . . . . 0.0 109.325 176.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 m -39.78 100.57 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.424 -170.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.551 HE21 HG23 ' A' ' 20' ' ' THR . 8.5 tp-100 -81.14 -38.29 27.41 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.469 -170.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.648 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.2 OUTLIER -89.34 142.87 27.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.578 -1.192 . . . . 0.0 112.641 -165.749 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 mt -109.57 145.6 36.09 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 125.959 1.704 . . . . 0.0 108.742 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -83.01 98.42 9.25 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 175.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.0 mt -107.75 121.89 45.63 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.433 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 82.6 mtt85 -88.87 133.75 34.18 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -125.75 129.69 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -133.38 144.36 49.53 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.036 0.534 . . . . 0.0 110.08 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.576 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -81.37 171.69 53.31 Favored Glycine 0 C--N 1.345 1.052 0 O-C-N 123.654 0.596 . . . . 0.0 112.685 175.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -41.18 -34.05 0.42 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.589 1.156 . . . . 0.0 112.398 163.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -93.21 105.64 17.7 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -71.25 -14.42 62.23 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -168.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -65.14 -31.04 72.03 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.207 0.603 . . . . 0.0 110.086 172.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.72 87.84 1.72 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.3 m -121.66 127.66 51.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.655 0.782 . . . . 0.0 110.042 -176.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -140.0 131.26 26.62 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.543 1.137 . . . . 0.0 108.042 -178.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.433 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.8 pt-20 -119.01 125.15 48.7 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.63 153.87 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.56 -171.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 m -91.42 108.68 20.06 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.452 HD22 HD22 ' A' ' 49' ' ' LEU . 23.1 tp -107.1 124.75 50.13 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 122.872 0.469 . . . . 0.0 109.746 175.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.648 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 43.1 m -72.52 134.99 45.54 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.601 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.0 ptm180 -73.55 -11.32 60.4 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -171.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -92.45 -17.58 24.37 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.865 0.866 . . . . 0.0 110.325 171.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -94.18 143.88 27.12 Favored Pre-proline 0 C--N 1.354 0.761 0 C-N-CA 124.013 0.925 . . . . 0.0 109.701 -178.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.468 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -72.81 160.57 45.86 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.706 2.271 . . . . 0.0 112.928 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.505 HD12 ' HE1' ' A' ' 87' ' ' MET . 3.1 mm? -56.64 -23.94 44.84 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.399 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -37.55 73.77 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.468 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -71.0 -27.88 64.02 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.008 0.433 . . . . 0.0 110.911 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -74.0 -41.18 62.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.945 0.898 . . . . 0.0 110.286 172.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -55.35 -44.28 75.81 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.057 0.943 . . . . 0.0 110.781 176.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -72.26 -35.97 68.92 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.443 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -70.22 -48.11 58.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.263 0.625 . . . . 0.0 110.537 -175.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.3 -58.85 6.03 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.349 1.06 . . . . 0.0 111.621 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.538 ' HA ' HD22 ' A' ' 62' ' ' LEU . 13.8 pt-20 -58.59 -28.71 65.84 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.913 0.758 . . . . 0.0 112.409 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.56 -40.65 63.78 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.22 -52.23 66.44 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -172.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.47 36.75 1.95 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 122.102 -0.374 . . . . 0.0 110.46 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 38.43 52.8 2.31 Favored Glycine 0 CA--C 1.541 1.658 0 N-CA-C 116.235 1.254 . . . . 0.0 116.235 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.538 HD22 ' HA ' ' A' ' 57' ' ' GLU . 3.0 mm? -77.59 9.23 3.51 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.378 0.671 . . . . 0.0 111.583 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.6 p -61.59 95.55 0.05 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.327 1.051 . . . . 0.0 110.062 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.1 -48.0 0.32 Allowed Glycine 0 C--N 1.338 0.647 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 -175.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.3 mtm105 -131.58 128.12 38.55 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.08 138.85 31.14 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -117.89 154.24 32.19 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.224 1.01 . . . . 0.0 110.374 -173.149 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.438 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 16.4 m -84.47 161.12 20.4 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.514 0.726 . . . . 0.0 110.623 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 32.0 m-85 -128.13 127.54 43.21 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.012 0.925 . . . . 0.0 109.156 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -123.08 137.13 55.01 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.77 0.828 . . . . 0.0 110.764 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.521 ' HB3' HD21 ' A' ' 76' ' ' LEU . 28.2 t80 -116.79 110.52 18.51 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.731 1.212 . . . . 0.0 108.318 174.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.1 t70 52.5 39.06 27.16 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-O 121.815 0.817 . . . . 0.0 111.019 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 71.52 22.52 78.62 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 114.91 -1.041 . . . . 0.0 114.656 -177.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.3 m -102.98 120.44 40.64 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.085 0.954 . . . . 0.0 109.128 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.0 114.99 6.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.91 0.484 . . . . 0.0 110.229 177.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.521 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.2 mt -84.6 120.89 26.88 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 27.4 m -77.13 -35.47 56.19 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.777 0.831 . . . . 0.0 112.509 -175.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.73 7.02 13.85 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 123.291 0.472 . . . . 0.0 113.49 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -127.59 10.89 6.71 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 124.036 0.934 . . . . 0.0 110.763 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.414 ' HG3' HD22 ' A' ' 85' ' ' LEU . 1.2 pm0 -105.08 147.84 27.45 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 174.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.99 154.17 37.45 Favored Pre-proline 0 C--N 1.311 -1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 108.579 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.601 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 44.7 Cg_endo -65.43 -29.35 53.69 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.749 1.632 . . . . 0.0 111.187 177.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.17 93.68 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.202 0.601 . . . . 0.0 110.596 172.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.03 -38.23 82.28 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.895 0.878 . . . . 0.0 111.909 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.414 HD22 ' HG3' ' A' ' 80' ' ' GLU . 70.2 mt -77.14 -24.77 51.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.649 0.779 . . . . 0.0 111.437 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.34 24.86 20.6 Favored Glycine 0 C--N 1.348 1.202 0 C-N-CA 122.036 -0.126 . . . . 0.0 113.035 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.505 ' HE1' HD12 ' A' ' 49' ' ' LEU . 63.1 mtt -74.76 170.63 15.48 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.304 1.041 . . . . 0.0 110.798 171.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -155.61 174.7 14.91 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 15.04 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -172.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.66 55.59 0.42 Allowed Glycine 0 C--N 1.342 0.903 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -106.97 -173.2 2.24 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.7 tp -140.02 134.74 31.84 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 121.72 0.771 . . . . 0.0 110.064 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.9 mt -127.94 151.95 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.558 1.543 . . . . 0.0 108.549 -178.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -116.78 165.04 13.76 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.504 1.121 . . . . 0.0 108.538 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.576 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 15.8 t -140.9 112.56 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.314 1.046 . . . . 0.0 108.805 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -115.28 98.01 6.52 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.495 1.118 . . . . 0.0 108.947 -176.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.401 ' HA3' ' HB3' ' A' ' 67' ' ' LEU . . . . . . . . 0 C--O 1.25 1.144 0 CA-C-O 118.917 -0.935 . . . . 0.0 111.136 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.507 ' HG3' HG23 ' A' ' 22' ' ' THR . 10.2 pt-20 -67.73 -34.96 77.87 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.244 0.618 . . . . 0.0 109.663 172.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.507 HG23 ' HG3' ' A' ' 21' ' ' GLU . 7.5 t -153.33 157.9 40.74 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.901 1.281 . . . . 0.0 108.116 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.4 t -66.2 -33.38 75.62 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.108 0.563 . . . . 0.0 111.857 -174.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -66.34 -14.74 62.52 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -171.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.516 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -113.72 152.5 30.43 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 111.464 -179.182 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt -113.29 150.16 32.89 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.787 1.635 . . . . 0.0 108.722 177.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.17 108.09 19.42 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.503 HD22 ' HB3' ' A' ' 43' ' ' LEU . 1.4 mm? -109.47 141.86 41.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -176.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -97.72 123.77 41.78 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.792 0.837 . . . . 0.0 109.42 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -110.17 116.6 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -177.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -132.06 139.06 48.41 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.744 0.418 . . . . 0.0 110.069 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.528 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -100.64 179.31 29.1 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 123.512 0.508 . . . . 0.0 113.892 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.464 ' HB3' ' HZ2' ' A' ' 33' ' ' LYS . 8.0 mtpm? -50.73 -15.27 0.26 Allowed 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -97.63 144.88 26.85 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.478 0.711 . . . . 0.0 109.151 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -67.51 -30.25 69.87 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 165.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -58.6 -38.1 77.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.599 1.56 . . . . 0.0 111.623 174.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -89.0 87.05 7.07 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.242 -169.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -124.66 131.86 53.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.296 0.638 . . . . 0.0 109.803 167.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -140.33 126.14 19.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.84 127.09 51.59 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.543 0.687 . . . . 0.0 109.184 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -133.88 151.11 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.061 0.944 . . . . 0.0 111.474 -168.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 67.8 m -93.39 106.92 18.83 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.015 176.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HB3' HD22 ' A' ' 28' ' ' LEU . 28.9 tp -107.34 131.94 53.68 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.427 1.091 . . . . 0.0 109.309 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 35.1 m -77.8 144.64 36.94 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.623 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 11.9 ptm85 -71.05 -9.32 57.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.575 0.35 . . . . 0.0 111.934 -175.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -94.86 -30.84 13.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.415 1.086 . . . . 0.0 109.849 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 m -82.11 139.28 45.72 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.969 0.907 . . . . 0.0 109.962 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.534 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 16.4 Cg_exo -62.21 153.79 67.41 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.962 2.441 . . . . 0.0 113.6 177.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.424 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.7 mm? -53.59 -29.5 37.86 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.596 170.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.534 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -58.22 -36.96 73.93 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.08 0.552 . . . . 0.0 112.428 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.84 -33.23 75.36 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 120.976 0.417 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -73.29 -42.61 62.21 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.929 1.292 . . . . 0.0 110.792 173.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.435 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 65.9 mtt -57.06 -46.04 82.76 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.444 1.098 . . . . 0.0 110.503 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 p -69.67 -33.78 73.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.272 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.46 -52.19 59.26 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.625 0.77 . . . . 0.0 110.538 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.408 ' CZ ' HG22 ' A' ' 95' ' ' VAL . 52.5 t80 -52.92 -60.2 3.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 111.831 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.518 ' HA ' HD23 ' A' ' 62' ' ' LEU . 7.9 pt-20 -57.87 -34.19 69.5 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 124.283 0.99 . . . . 0.0 111.986 -177.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.81 -47.4 85.29 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 173.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.05 -43.47 73.84 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -112.72 30.14 7.38 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 122.487 0.315 . . . . 0.0 110.998 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 39.49 47.99 2.95 Favored Glycine 0 N--CA 1.481 1.693 0 N-CA-C 117.275 1.67 . . . . 0.0 117.275 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.518 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.0 mm? -73.17 82.88 1.32 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.713 . . . . 0.0 110.098 175.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.5 p -102.22 -58.28 1.91 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.967 0.907 . . . . 0.0 110.249 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.75 -36.5 61.73 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.887 -179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -106.91 97.65 7.41 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -94.22 145.5 24.67 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.428 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -127.06 165.71 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.728 0.811 . . . . 0.0 111.434 -164.852 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.9 m -99.64 152.99 19.44 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.702 0.801 . . . . 0.0 110.169 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -115.59 127.25 55.09 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.751 0.82 . . . . 0.0 109.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -122.79 140.96 52.35 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.931 0.892 . . . . 0.0 110.005 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.497 ' HB3' HD21 ' A' ' 76' ' ' LEU . 67.2 t80 -129.74 114.17 15.64 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.941 0.896 . . . . 0.0 108.661 174.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 56.61 34.29 24.2 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.382 1.073 . . . . 0.0 110.459 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 79.09 -2.65 68.97 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.397 -0.819 . . . . 0.0 114.243 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 97.1 m -81.49 126.87 32.19 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 117.663 0.731 . . . . 0.0 110.233 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -71.27 116.02 11.11 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 123.735 0.647 . . . . 0.0 109.65 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.497 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.6 mt -87.51 130.32 34.76 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -92.45 -25.0 18.65 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.659 0.784 . . . . 0.0 111.489 -177.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.93 -41.56 1.77 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 123.167 0.413 . . . . 0.0 113.092 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -76.71 -18.75 58.32 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.985 0.914 . . . . 0.0 112.591 -170.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.511 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.8 pm0 -71.99 149.1 45.29 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 48' ' ' PRO . 16.6 mt -103.95 152.02 38.99 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.623 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 43.3 Cg_endo -64.03 -21.94 68.12 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.06 1.84 . . . . 0.0 111.708 -178.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.56 -44.35 89.66 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.054 0.941 . . . . 0.0 111.588 171.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -74.72 -39.71 61.74 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.614 0.766 . . . . 0.0 111.535 -176.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.511 HD21 ' HG3' ' A' ' 80' ' ' GLU . 95.0 mt -69.81 -23.27 63.3 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.07 0.548 . . . . 0.0 111.476 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.91 55.8 3.24 Favored Glycine 0 C--N 1.344 0.977 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 -174.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.433 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 61.0 mtp -107.74 159.62 16.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.075 0.95 . . . . 0.0 109.33 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -148.59 165.94 29.76 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.7 t -59.92 108.65 0.79 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 131.52 -31.95 3.02 Favored Glycine 0 C--N 1.354 1.534 0 CA-C-O 119.363 -0.687 . . . . 0.0 113.669 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.15 167.24 0.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -177.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.7 tp -131.61 110.48 10.97 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 121.468 0.652 . . . . 0.0 109.538 -162.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.413 HD12 ' HE3' ' A' ' 87' ' ' MET . 38.3 mt -90.65 148.75 4.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.354 173.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -114.92 156.91 24.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -171.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.528 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 19.0 t -135.04 109.23 11.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -102.86 94.03 5.37 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.398 -1.273 . . . . 0.0 108.043 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.896 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -178.824 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -141.09 -17.62 0.82 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -166.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -61.38 119.89 9.39 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 121.165 1.802 . . . . 0.0 111.346 -135.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 t -100.29 130.78 46.44 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 110.896 -2.866 . . . . 0.0 115.611 -134.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -80.41 -54.88 5.3 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 155.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -130.69 152.67 49.8 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.225 1.01 . . . . 0.0 109.963 175.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.3 mt -97.1 123.54 40.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.449 1.5 . . . . 0.0 107.734 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -85.73 103.26 14.36 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 44.2 mt -111.25 132.87 54.01 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -175.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 mtt85 -99.48 126.86 45.49 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.95 133.03 52.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.704 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.406 ' HG3' ' HA ' ' A' ' 38' ' ' THR . 0.9 OUTLIER -139.9 153.43 46.97 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.884 0.873 . . . . 0.0 108.936 174.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.527 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -91.75 -170.62 41.87 Favored Glycine 0 C--N 1.34 0.764 0 O-C-N 123.526 0.516 . . . . 0.0 112.635 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -37.5 -39.94 0.35 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.084 0.954 . . . . 0.0 111.801 157.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -89.92 112.67 24.13 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 168.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.599 ' HZ2' ' HB3' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -71.58 -17.56 62.29 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 120.73 0.3 . . . . 0.0 110.825 174.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -71.65 -27.88 63.38 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.401 0.68 . . . . 0.0 110.09 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -76.04 87.57 2.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.406 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 26.5 m -115.13 136.99 52.52 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.515 0.726 . . . . 0.0 110.894 -173.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 tp -137.71 134.88 35.89 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -109.77 125.36 52.62 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -134.26 146.68 30.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.794 0.838 . . . . 0.0 110.605 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.7 p -95.55 107.68 19.87 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 175.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.497 ' HB2' HD11 ' A' ' 52' ' ' LEU . 26.5 tp -88.49 131.14 35.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.547 -0.752 . . . . 0.0 108.992 175.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -73.82 139.88 45.41 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -61.91 -27.94 69.18 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.471 0.708 . . . . 0.0 112.477 -171.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -86.85 -27.76 23.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.101 0.96 . . . . 0.0 111.277 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -84.9 133.78 42.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.484 0.714 . . . . 0.0 110.842 -168.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.535 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 6.1 Cg_exo -60.09 157.05 36.22 Favored 'Trans proline' 0 C--N 1.378 2.113 0 C-N-CA 122.74 2.293 . . . . 0.0 113.085 177.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.0 mm? -55.02 -26.98 40.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.581 1.152 . . . . 0.0 112.236 176.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.535 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.0 pttt -59.49 -33.3 71.16 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.442 HG22 ' O ' ' A' ' 48' ' ' PRO . 3.0 t -68.76 -32.48 72.25 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.343 0.592 . . . . 0.0 110.21 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 43' ' ' LEU . 7.0 tt -74.15 -38.69 63.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.925 1.29 . . . . 0.0 110.376 173.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.9 mtt -59.04 -41.29 87.48 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.014 0.926 . . . . 0.0 110.592 176.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.424 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 24.1 m -64.44 -41.85 96.33 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 124.634 1.209 . . . . 0.0 109.789 176.033 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.42 -50.1 74.2 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.074 0.55 . . . . 0.0 110.495 -176.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -55.42 -58.01 9.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.958 0.903 . . . . 0.0 112.178 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.98 -39.1 93.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.982 -174.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 54' ' ' SER . 30.6 mm-40 -65.76 -46.33 79.19 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.25 60.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.302 1.041 . . . . 0.0 113.566 -171.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtm -104.06 36.73 2.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.731 0.412 . . . . 0.0 111.546 -174.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 43.85 53.59 6.26 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -87.04 45.99 1.33 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.631 0.772 . . . . 0.0 109.141 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.5 m -74.01 124.35 26.07 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.811 0.844 . . . . 0.0 110.807 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.84 -58.14 3.3 Favored Glycine 0 C--N 1.344 1.008 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -178.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 45.8 mtm105 -75.29 101.61 4.76 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.342 0.657 . . . . 0.0 110.426 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 tppt? -79.63 148.27 31.72 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 172.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.465 ' N ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.93 155.33 45.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.161 0.984 . . . . 0.0 109.599 -177.076 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.459 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 17.5 m -85.68 150.69 24.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.484 0.714 . . . . 0.0 110.347 -176.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -119.89 130.11 54.69 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.711 0.804 . . . . 0.0 109.88 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.437 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 17.6 m-85 -124.63 155.59 38.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.009 0.924 . . . . 0.0 110.335 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.503 ' HB3' HD21 ' A' ' 76' ' ' LEU . 56.9 t80 -140.25 112.32 7.65 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.37 1.068 . . . . 0.0 108.956 172.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 57.3 32.12 21.23 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.355 1.062 . . . . 0.0 110.995 -174.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.22 -0.45 89.71 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.645 -1.161 . . . . 0.0 114.28 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 86.3 m -83.54 122.12 28.14 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.346 0.658 . . . . 0.0 110.084 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -67.42 114.32 6.01 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.503 HD21 ' HB3' ' A' ' 71' ' ' PHE . 30.6 mt -86.42 118.93 26.17 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -78.77 -30.56 45.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.72 0.808 . . . . 0.0 112.473 -176.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.6 -47.28 1.03 Allowed Glycine 0 CA--C 1.524 0.604 0 CA-C-N 116.302 -0.408 . . . . 0.0 112.827 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -77.09 -19.74 56.64 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.439 0.696 . . . . 0.0 112.532 -169.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.431 ' HG3' HD23 ' A' ' 85' ' ' LEU . 2.1 pm0 -69.58 149.03 48.61 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.792 0.806 . . . . 0.0 109.459 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 65.3 mt -101.96 157.4 33.77 Favored Pre-proline 0 C--N 1.309 -1.194 0 C-N-CA 125.17 1.388 . . . . 0.0 108.626 -174.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -65.24 -35.02 42.96 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 121.827 1.685 . . . . 0.0 111.515 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.31 -36.39 79.99 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.716 0.806 . . . . 0.0 111.163 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.66 -46.55 75.35 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.995 0.918 . . . . 0.0 111.473 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.431 HD23 ' HG3' ' A' ' 80' ' ' GLU . 55.6 mt -75.34 -17.1 60.33 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.22 22.73 53.87 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.132 -0.486 . . . . 0.0 113.111 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.459 ' HE2' HD13 ' A' ' 49' ' ' LEU . 48.5 mtt -64.51 152.16 42.52 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.339 1.056 . . . . 0.0 112.165 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -146.91 157.23 43.58 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 -175.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 54.7 p -56.6 117.42 3.86 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.194 0.598 . . . . 0.0 111.173 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.09 -8.65 29.2 Favored Glycine 0 C--N 1.34 0.758 0 CA-C-O 119.603 -0.554 . . . . 0.0 113.501 178.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -60.06 160.33 8.21 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 117.446 0.623 . . . . 0.0 111.868 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.2 tp -124.77 108.79 12.34 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -163.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.6 mt -88.63 150.03 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 39.8 mt-10 -112.26 155.32 24.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.502 1.121 . . . . 0.0 108.216 -171.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.527 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 41.7 t -136.02 107.45 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.763 0.825 . . . . 0.0 108.836 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.459 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 9.7 m0 -101.85 97.58 7.94 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -177.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.141 -176.723 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -159.73 162.57 34.98 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 -171.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -74.83 150.51 39.25 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 169.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.3 m 60.54 29.73 19.23 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 124.395 1.078 . . . . 0.0 112.197 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -82.26 -14.12 55.97 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.57 0.748 . . . . 0.0 111.362 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.464 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 8.6 mp0 -81.56 131.37 35.27 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.107 -167.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 69.9 mt -97.0 125.85 41.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.28 1.032 . . . . 0.0 108.256 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -77.26 99.0 5.33 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.6 mt -112.39 133.72 54.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.481 0.712 . . . . 0.0 109.598 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -96.5 136.39 37.07 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.424 HG12 ' HB ' ' A' ' 93' ' ' ILE . 1.9 t -125.01 134.05 67.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -132.6 146.96 52.3 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 118.221 0.464 . . . . 0.0 110.496 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.563 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -97.06 174.13 29.75 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 124.023 0.827 . . . . 0.0 112.26 171.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -50.69 -19.45 0.94 Allowed 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 173.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -94.09 155.25 17.19 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.455 0.702 . . . . 0.0 110.179 -176.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.93 -47.08 72.8 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.685 0.794 . . . . 0.0 112.847 -171.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -87.94 -17.31 31.59 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.374 0.67 . . . . 0.0 110.935 -176.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.419 ' HG3' ' OH ' ' A' ' 56' ' ' TYR . 21.8 tp60 -69.48 84.36 0.41 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.103 0.561 . . . . 0.0 109.581 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.9 m -138.24 131.74 30.7 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.372 1.069 . . . . 0.0 109.146 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -140.76 132.57 27.46 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -120.88 129.48 53.52 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -174.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.4 p -132.14 149.53 32.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.841 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.2 p -94.98 105.78 17.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.0 tp -108.09 107.55 18.25 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.697 177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 26.9 m -32.92 120.49 0.35 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 113.093 158.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.59 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.7 ptm180 -64.03 -13.61 48.22 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -172.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 44.5 p-10 -98.68 -14.22 19.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.163 0.985 . . . . 0.0 111.092 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m -92.82 141.05 23.85 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.038 0.935 . . . . 0.0 110.124 -175.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.541 ' O ' HG22 ' A' ' 51' ' ' THR . 14.6 Cg_exo -61.12 149.33 89.69 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.313 2.675 . . . . 0.0 113.201 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.666 HD11 ' HE2' ' A' ' 87' ' ' MET . 3.9 mm? -53.58 -29.86 39.37 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.036 -0.983 . . . . 0.0 112.336 172.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.469 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -54.89 -37.78 66.75 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.502 0.721 . . . . 0.0 112.307 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.541 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.4 t -69.42 -36.83 77.09 Favored 'General case' 0 CA--C 1.554 1.133 0 O-C-N 123.118 0.262 . . . . 0.0 110.58 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.01 -45.18 82.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.293 1.037 . . . . 0.0 110.531 175.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.488 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -54.94 -47.35 74.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.129 176.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 t -66.81 -33.79 76.4 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.463 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -67.29 -49.86 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.423 0.689 . . . . 0.0 110.159 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.439 ' CZ ' HG23 ' A' ' 95' ' ' VAL . 46.7 t80 -54.98 -60.77 2.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.167 0.987 . . . . 0.0 111.449 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.51 ' HA ' HD22 ' A' ' 62' ' ' LEU . 11.4 pt-20 -62.7 -39.38 93.81 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.549 -173.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.78 -37.75 85.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 175.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.36 -45.05 76.51 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -109.6 36.54 2.92 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 120.831 0.348 . . . . 0.0 110.617 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 35.79 42.56 0.52 Allowed Glycine 0 N--CA 1.482 1.711 0 N-CA-C 118.326 2.09 . . . . 0.0 118.326 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.51 HD22 ' HA ' ' A' ' 57' ' ' GLU . 2.8 mm? -72.35 88.45 1.18 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.902 0.851 . . . . 0.0 109.922 170.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -128.72 -20.5 3.54 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.378 0.671 . . . . 0.0 110.879 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.35 -32.16 71.82 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 174.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -137.36 145.65 43.58 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.032 0.933 . . . . 0.0 108.761 171.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -99.15 146.7 25.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 171.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.475 ' HB3' ' HA3' ' A' ' 97' ' ' GLY . 0.0 OUTLIER -126.51 152.7 46.15 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.575 0.75 . . . . 0.0 110.758 -172.258 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.434 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 50.0 m -89.46 162.62 15.64 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.105 -177.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.461 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 45.2 m-85 -132.27 128.12 37.13 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.489 1.116 . . . . 0.0 109.249 -174.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.508 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 31.6 m-85 -125.15 122.66 37.74 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.54 0.736 . . . . 0.0 110.636 -177.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.548 ' HB3' HD23 ' A' ' 76' ' ' LEU . 27.5 t80 -98.73 106.89 19.21 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 52.01 46.11 27.15 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.259 1.023 . . . . 0.0 111.618 -171.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 76.5 1.03 69.28 Favored Glycine 0 C--N 1.347 1.175 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.907 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 54.5 m -86.64 113.02 22.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.499 0.72 . . . . 0.0 109.303 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -59.02 115.4 3.12 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.818 0.698 . . . . 0.0 109.512 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.548 HD23 ' HB3' ' A' ' 71' ' ' PHE . 56.6 mt -88.5 127.65 35.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.131 0.972 . . . . 0.0 108.863 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.4 t -81.44 -25.55 36.05 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.697 0.799 . . . . 0.0 111.422 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.74 -47.86 1.0 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 123.78 0.705 . . . . 0.0 112.436 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -93.97 11.28 30.19 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.665 0.786 . . . . 0.0 112.365 -168.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.518 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -85.88 150.17 24.71 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 165.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.1 mt -102.26 160.37 26.57 Favored Pre-proline 0 C--N 1.309 -1.184 0 C-N-CA 124.806 1.242 . . . . 0.0 107.922 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.59 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 36.7 Cg_endo -67.22 -20.08 49.79 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.423 1.415 . . . . 0.0 111.839 171.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.88 92.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.4 0.68 . . . . 0.0 110.564 168.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -75.2 -45.46 40.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.038 0.935 . . . . 0.0 110.723 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.518 HD21 ' HG3' ' A' ' 80' ' ' GLU . 96.0 mt -68.66 -23.97 64.48 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.029 0.932 . . . . 0.0 112.783 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 71.53 64.51 2.71 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.666 ' HE2' HD11 ' A' ' 49' ' ' LEU . 30.7 ttp -128.39 153.78 46.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.35 1.06 . . . . 0.0 108.721 -173.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -149.49 167.18 26.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.598 0.759 . . . . 0.0 109.1 -170.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 m -55.71 117.85 4.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.463 0.705 . . . . 0.0 111.323 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 120.94 -21.79 8.24 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-O 119.816 -0.435 . . . . 0.0 113.245 177.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.32 169.29 0.89 Allowed 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.61 110.51 9.95 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.917 -166.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.424 ' HB ' HG12 ' A' ' 30' ' ' VAL . 62.1 mt -95.46 150.29 4.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.415 175.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.508 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 34.9 mt-10 -109.96 165.06 12.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.038 0.935 . . . . 0.0 108.7 -171.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.563 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 46.0 t -139.89 109.49 3.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 123.995 0.918 . . . . 0.0 108.912 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -119.34 99.92 6.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.574 1.149 . . . . 0.0 108.69 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . 0.475 ' HA3' ' HB3' ' A' ' 67' ' ' LEU . . . . . . . . 0 C--O 1.249 1.071 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.426 HG23 HE22 ' A' ' 24' ' ' GLN . 40.1 p . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -117.7 -35.94 3.81 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.868 0.867 . . . . 0.0 112.02 -171.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.2 p -70.25 121.6 17.91 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 118.311 -0.852 . . . . 0.0 108.853 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -40.26 74.14 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 126.389 1.875 . . . . 0.0 115.487 -165.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.426 HE22 HG23 ' A' ' 20' ' ' THR . 9.1 tt0 -83.37 -35.14 25.35 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.811 2.044 . . . . 0.0 111.925 173.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.442 ' OE1' ' HB3' ' A' ' 42' ' ' SER . 3.9 pp0? -86.33 157.93 19.77 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.015 1.326 . . . . 0.0 112.892 -153.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.96 134.02 38.08 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.799 -160.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.62 103.37 15.76 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 45.2 mt -109.33 130.6 55.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.004 0.522 . . . . 0.0 109.935 -174.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -92.94 128.56 38.85 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.86 121.31 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -173.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -127.62 137.44 52.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.773 0.429 . . . . 0.0 109.887 -171.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.567 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -76.46 173.18 54.41 Favored Glycine 0 C--N 1.343 0.942 0 O-C-N 123.745 0.653 . . . . 0.0 112.46 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -41.93 -37.48 1.33 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.827 0.851 . . . . 0.0 112.073 164.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -87.87 117.56 26.8 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.966 1.307 . . . . 0.0 108.358 169.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -71.16 -21.01 62.23 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.224 0.61 . . . . 0.0 111.876 -173.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -63.27 -30.8 71.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.533 0.733 . . . . 0.0 110.177 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -76.38 90.4 3.23 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.1 m -126.73 126.31 43.25 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.534 0.734 . . . . 0.0 109.445 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.68 122.83 20.4 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -115.46 122.72 46.63 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.025 0.917 . . . . 0.0 109.355 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.82 147.44 29.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.793 0 C-N-CA 125.045 1.338 . . . . 0.0 109.484 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.442 ' HB3' ' OE1' ' A' ' 25' ' ' GLN . 6.0 m -90.86 107.15 19.0 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 27.3 tp -104.71 131.61 51.95 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.749 0.82 . . . . 0.0 109.026 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.3 m -75.88 137.15 40.23 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.656 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 9.1 ptm180 -72.21 -6.79 45.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.742 0.306 . . . . 0.0 111.746 -175.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -92.4 -37.7 12.42 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.646 1.178 . . . . 0.0 109.887 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 m -78.01 132.55 67.06 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.599 0.76 . . . . 0.0 110.682 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 81' ' ' LEU . 10.7 Cg_endo -64.54 162.07 32.6 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.545 2.163 . . . . 0.0 113.974 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.52 HD12 ' HE3' ' A' ' 87' ' ' MET . 3.5 mm? -53.92 -28.03 34.32 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.433 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.83 -36.22 58.41 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -177.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 48' ' ' PRO . 10.9 t -73.26 -33.76 65.45 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 120.892 0.377 . . . . 0.0 111.129 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.72 -42.7 85.92 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.258 1.023 . . . . 0.0 110.322 172.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.465 ' HE1' ' HB3' ' A' ' 49' ' ' LEU . 66.1 mtt -58.63 -49.36 77.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.558 1.143 . . . . 0.0 110.636 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.8 p -67.15 -32.84 74.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 124.813 1.321 . . . . 0.0 109.778 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -67.43 -53.5 28.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 122.845 0.458 . . . . 0.0 110.065 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -55.27 -60.16 3.79 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.613 1.165 . . . . 0.0 111.389 -178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 53' ' ' MET . 12.3 pt-20 -56.91 -49.87 74.28 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.015 0.822 . . . . 0.0 110.901 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.26 -27.1 66.04 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.46 -43.24 97.1 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -109.12 27.0 9.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.663 0.385 . . . . 0.0 111.097 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 42.73 65.29 1.4 Allowed Glycine 0 N--CA 1.48 1.63 0 N-CA-C 116.582 1.393 . . . . 0.0 116.582 -177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -90.33 9.78 27.49 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.605 1.162 . . . . 0.0 110.504 173.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.9 p -62.79 97.75 0.11 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.072 0.949 . . . . 0.0 110.651 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.87 -43.86 0.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -131.05 130.27 43.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 172.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -86.76 143.47 27.51 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.414 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -113.88 153.2 29.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.017 0.927 . . . . 0.0 109.998 -175.284 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.412 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 41.3 m -87.82 130.81 34.75 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.495 -173.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -101.64 133.05 46.94 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.121 0.969 . . . . 0.0 110.035 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.475 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 98.3 m-85 -128.73 132.39 47.97 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.306 0.642 . . . . 0.0 111.175 177.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.465 ' HB3' HD21 ' A' ' 76' ' ' LEU . 15.7 t80 -120.63 108.52 14.12 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.6 t70 59.5 26.22 15.15 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-O 122.045 0.926 . . . . 0.0 110.456 -172.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.75 -2.9 87.33 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.517 -0.765 . . . . 0.0 114.272 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.434 ' O ' ' HA ' ' A' ' 70' ' ' PHE . 90.9 m -73.51 125.92 29.04 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 117.581 0.69 . . . . 0.0 110.197 175.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -68.66 114.03 6.67 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 123.62 0.575 . . . . 0.0 109.64 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.465 HD21 ' HB3' ' A' ' 71' ' ' PHE . 12.2 mt -93.95 124.59 38.05 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 175.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.2 m -111.56 -14.19 13.71 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.31 -63.17 0.54 Allowed Glycine 0 C--N 1.345 1.065 0 N-CA-C 113.599 0.2 . . . . 0.0 113.599 176.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -77.8 -5.14 49.79 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -167.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -81.43 147.63 29.67 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 17.6 mt -99.6 153.16 37.91 Favored Pre-proline 0 C--N 1.312 -1.056 0 C-N-CA 125.343 1.457 . . . . 0.0 108.128 -176.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.656 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 50.0 Cg_endo -66.29 -36.23 28.74 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 121.768 1.645 . . . . 0.0 111.317 177.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.14 75.2 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.083 0.553 . . . . 0.0 110.966 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -65.94 -43.7 87.26 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.778 . . . . 0.0 110.624 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.6 mt -74.85 -24.83 58.65 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.63 0.772 . . . . 0.0 111.999 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 91.47 55.21 1.83 Allowed Glycine 0 C--N 1.343 0.919 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.52 ' HE3' HD12 ' A' ' 49' ' ' LEU . 63.4 mtt -104.34 161.87 13.7 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.986 0.914 . . . . 0.0 110.653 178.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.5 tp10 -148.9 160.42 43.27 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.928 0.891 . . . . 0.0 108.689 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 t -62.66 118.07 7.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.347 0.659 . . . . 0.0 110.72 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.34 41.19 3.04 Favored Glycine 0 C--N 1.34 0.771 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -173.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.5 t0 -103.9 -175.75 2.89 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.338 0.655 . . . . 0.0 109.444 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 30.9 tp -138.66 134.79 34.14 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.472 0.653 . . . . 0.0 109.447 -174.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 54.1 mt -126.54 150.39 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.923 1.289 . . . . 0.0 108.194 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 28.5 mt-10 -117.88 156.4 28.49 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 -171.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.567 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 10.2 t -140.14 139.41 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.567 0.747 . . . . 0.0 110.265 -174.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.1 m95 -135.73 95.08 3.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.812 1.245 . . . . 0.0 109.653 -175.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.3 0 CA-C-O 118.946 -0.919 . . . . 0.0 111.87 -176.786 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.484 1.227 0 CA-C-O 120.687 0.28 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -100.2 -12.63 19.41 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.417 0.687 . . . . 0.0 110.898 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.5 p -68.31 121.45 16.29 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -46.36 81.47 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.821 1.649 . . . . 0.0 114.738 -163.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.476 ' O ' ' HD2' ' A' ' 45' ' ' ARG . 1.3 pp0? -80.3 -38.15 31.33 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.396 -1.275 . . . . 0.0 107.869 165.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -89.53 154.33 20.09 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 113.849 -1.523 . . . . 0.0 110.303 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.462 HD12 ' HB2' ' A' ' 82' ' ' PRO . 44.6 mt -99.01 123.36 43.25 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.306 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -87.28 101.87 13.95 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.626 HD13 ' SD ' ' A' ' 87' ' ' MET . 28.2 mt -113.55 154.7 26.68 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.498 0.719 . . . . 0.0 111.203 -168.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.6 mtm105 -112.19 136.28 51.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.188 0.595 . . . . 0.0 110.955 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -120.29 126.04 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.216 1.407 . . . . 0.0 108.899 173.585 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -129.12 129.16 44.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.601 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -89.98 175.11 41.36 Favored Glycine 0 C--N 1.344 0.991 0 O-C-N 123.729 0.643 . . . . 0.0 113.63 -172.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -39.66 -37.15 0.48 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.07 1.348 . . . . 0.0 113.932 167.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -75.09 122.61 23.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -63.84 -31.93 73.28 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.538 0.735 . . . . 0.0 111.987 -176.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -76.34 -26.65 55.97 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.447 0.699 . . . . 0.0 110.76 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -67.03 94.94 0.36 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 -179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.1 m -115.74 119.31 35.62 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 169.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.441 ' HB3' HG23 ' A' ' 30' ' ' VAL . 1.5 tm? -128.57 128.13 43.67 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -121.16 121.31 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.765 0.793 . . . . 0.0 109.542 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -128.15 144.83 36.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 124.817 1.247 . . . . 0.0 110.823 -171.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p -93.39 112.17 24.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.814 0.845 . . . . 0.0 109.489 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.435 ' HB3' HD11 ' A' ' 28' ' ' LEU . 36.8 tp -110.09 133.9 52.73 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.924 0.889 . . . . 0.0 109.41 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 67.3 m -77.18 147.08 36.66 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.656 0.382 . . . . 0.0 109.992 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.476 ' HD2' ' O ' ' A' ' 24' ' ' GLN . 8.9 ptm180 -64.62 -25.9 68.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.663 0.785 . . . . 0.0 111.853 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -99.69 -16.05 18.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.258 1.023 . . . . 0.0 111.096 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.2 m -88.42 135.99 32.08 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.701 0.8 . . . . 0.0 109.438 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.518 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 2.8 Cg_endo -65.9 155.03 71.47 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 122.697 2.265 . . . . 0.0 113.283 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.542 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.4 mm? -53.04 -29.9 32.53 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 125.137 1.375 . . . . 0.0 112.255 176.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.518 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.2 pttt -55.96 -35.47 66.74 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.463 HG23 ' O ' ' A' ' 48' ' ' PRO . 7.0 t -70.3 -32.85 70.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.0 tt -70.85 -37.6 73.12 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.599 1.16 . . . . 0.0 110.235 173.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.2 mtt -61.99 -42.09 98.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.01 0.924 . . . . 0.0 110.397 176.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.5 m -66.92 -38.58 86.47 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 124.534 1.146 . . . . 0.0 110.227 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.76 -45.6 70.98 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 122.989 0.516 . . . . 0.0 110.311 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.83 -57.96 9.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.219 1.008 . . . . 0.0 111.8 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.414 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 11.5 pt-20 -61.1 -42.51 98.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 123.946 0.779 . . . . 0.0 110.512 -174.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.58 -29.48 70.08 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.41 -51.68 66.06 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -109.18 29.83 7.15 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 122.469 0.308 . . . . 0.0 111.416 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 44.97 64.79 2.04 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.414 ' HB2' ' HB2' ' A' ' 57' ' ' GLU . 3.9 mm? -91.19 20.44 5.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.302 1.041 . . . . 0.0 111.471 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.6 p -74.25 82.38 1.85 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 121.449 0.642 . . . . 0.0 109.743 174.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.49 -27.89 1.5 Allowed Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.197 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -126.46 95.46 4.37 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.33 1.052 . . . . 0.0 108.32 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -89.41 142.98 27.18 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.557 0.343 . . . . 0.0 110.233 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.418 HD12 ' N ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -129.82 162.03 29.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.525 1.13 . . . . 0.0 110.85 -170.587 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.0 m -98.16 168.09 10.47 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.253 0.621 . . . . 0.0 111.156 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -130.99 132.12 44.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.159 1.383 . . . . 0.0 109.007 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -127.73 112.4 14.76 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.753 0.821 . . . . 0.0 110.603 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.517 ' HB3' HD21 ' A' ' 76' ' ' LEU . 10.8 t80 -102.23 111.72 24.11 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.677 1.191 . . . . 0.0 107.819 174.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.4 t70 52.47 36.16 19.52 Favored 'General case' 0 CA--C 1.564 1.495 0 CA-C-O 121.977 0.894 . . . . 0.0 110.836 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 85.75 -16.12 43.21 Favored Glycine 0 N--CA 1.478 1.466 0 CA-C-N 115.062 -0.972 . . . . 0.0 114.745 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.5 m -70.51 121.0 16.99 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.287 0.635 . . . . 0.0 110.789 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -71.23 119.71 15.75 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.517 HD21 ' HB3' ' A' ' 71' ' ' PHE . 45.0 mt -91.37 126.82 36.58 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 124.289 1.036 . . . . 0.0 109.403 -177.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.7 m -90.35 -22.97 21.25 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.892 0.877 . . . . 0.0 112.38 -176.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.21 -49.72 0.92 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 120.103 -0.276 . . . . 0.0 113.604 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.4 mtm180 -82.54 1.29 38.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.703 0.801 . . . . 0.0 112.866 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -85.26 148.12 26.22 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.4 156.8 34.82 Favored Pre-proline 0 C--N 1.313 -1.0 0 C-N-CA 125.045 1.338 . . . . 0.0 108.097 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.462 ' HB2' HD12 ' A' ' 26' ' ' LEU . 73.7 Cg_endo -69.32 -25.06 31.01 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 121.531 1.487 . . . . 0.0 111.126 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.48 83.97 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.324 0.649 . . . . 0.0 110.56 171.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -67.11 -40.5 86.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.415 ' HB3' ' CE2' ' A' ' 71' ' ' PHE . 88.5 mt -73.55 -23.61 60.0 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.198 0.999 . . . . 0.0 111.902 176.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.78 23.68 52.11 Favored Glycine 0 C--N 1.349 1.288 0 O-C-N 123.236 0.335 . . . . 0.0 112.858 -176.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.626 ' SD ' HD13 ' A' ' 28' ' ' LEU . 32.8 ttm -73.85 160.66 31.11 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.388 1.475 . . . . 0.0 110.848 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -140.04 157.19 46.04 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.094 0.957 . . . . 0.0 109.548 -176.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.5 m -56.45 119.49 6.13 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.358 0.663 . . . . 0.0 111.119 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.46 -15.37 32.47 Favored Glycine 0 N--CA 1.475 1.262 0 CA-C-O 119.727 -0.485 . . . . 0.0 113.91 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.64 175.85 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.54 1.136 . . . . 0.0 112.561 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.4 tp -130.79 107.66 9.3 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -172.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.1 mt -89.75 149.85 3.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 168.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -115.79 163.45 15.82 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.601 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 98.8 t -135.76 119.61 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -130.04 111.17 12.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.362 1.065 . . . . 0.0 109.333 -176.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.099 0 CA-C-O 119.263 -0.743 . . . . 0.0 113.127 -176.363 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.574 0.702 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.57 -40.97 0.87 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.154 0.982 . . . . 0.0 110.552 -169.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -90.31 123.15 33.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.402 1.081 . . . . 0.0 108.149 170.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -67.72 70.95 0.13 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -171.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -81.43 -36.15 29.79 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.613 1.565 . . . . 0.0 108.225 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -87.37 156.12 19.74 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 113.369 -1.741 . . . . 0.0 111.941 -162.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.9 mt -92.71 128.39 38.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.26 -163.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -83.85 99.82 10.57 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.487 HD13 ' SD ' ' A' ' 87' ' ' MET . 64.9 mt -110.89 130.77 55.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.868 0.867 . . . . 0.0 109.63 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 -99.15 112.11 24.33 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.018 0.527 . . . . 0.0 109.855 -176.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -100.48 119.65 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.914 0.886 . . . . 0.0 109.435 176.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -123.27 134.69 54.07 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -174.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.431 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -65.96 157.15 49.03 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 173.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.2 pttm -53.64 -20.76 5.68 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.037 0.919 . . . . 0.0 112.299 173.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -70.59 108.92 4.58 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 163.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -58.91 -33.21 70.29 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -167.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -84.84 -11.67 55.19 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.09 104.58 7.66 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 173.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 40.8 m -121.72 128.73 52.12 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.151 0.98 . . . . 0.0 109.964 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -129.44 121.06 26.54 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -113.24 125.3 54.16 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.286 0.565 . . . . 0.0 109.72 -176.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -132.34 148.39 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.736 1.214 . . . . 0.0 110.599 -174.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.4 p -102.29 105.24 15.84 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.443 ' HB3' HD11 ' A' ' 28' ' ' LEU . 34.2 tp -91.53 135.84 33.56 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.573 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.4 m -74.19 136.69 42.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.7 ptm180 -71.51 -15.82 62.32 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -168.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -92.67 -36.73 12.79 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.988 0.915 . . . . 0.0 110.336 172.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -66.71 143.0 97.88 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 123.545 0.738 . . . . 0.0 111.249 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.432 ' O ' HG22 ' A' ' 51' ' ' THR . 0.9 OUTLIER -71.62 162.74 41.2 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.616 2.211 . . . . 0.0 113.1 176.873 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -56.06 -26.12 47.98 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.731 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.427 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 62.2 pttt -58.32 -37.53 75.27 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -70.56 -30.77 67.58 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 118.439 0.563 . . . . 0.0 110.82 178.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.99 -40.74 78.58 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.176 0.991 . . . . 0.0 110.428 172.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.458 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 65.1 mtt -58.41 -45.13 89.02 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.283 1.033 . . . . 0.0 110.046 175.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -66.28 -35.95 81.72 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 124.993 1.433 . . . . 0.0 110.703 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -68.88 -47.43 65.88 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.097 0.559 . . . . 0.0 110.258 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.36 -59.05 5.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.473 1.109 . . . . 0.0 111.819 177.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 53' ' ' MET . 10.5 pt-20 -62.54 -46.6 87.64 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.349 1.03 . . . . 0.0 111.401 -174.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -65.54 -34.53 78.47 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.28 76.06 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.491 0.716 . . . . 0.0 112.301 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 64.6 mtm -112.59 29.12 8.2 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.123 0.569 . . . . 0.0 111.743 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 41.77 67.76 0.78 Allowed Glycine 0 CA--C 1.545 1.909 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 57' ' ' GLU . 4.2 mm? -90.53 47.82 1.47 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.548 0.739 . . . . 0.0 111.093 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.0 p -71.18 124.44 24.47 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.397 174.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.43 -63.42 4.15 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -68.34 90.44 0.36 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.299 0.639 . . . . 0.0 110.19 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tppt? -101.57 147.37 26.48 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.412 HD11 ' HG ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -128.91 169.23 14.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.172 0.989 . . . . 0.0 111.21 -166.7 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.4 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 45.5 m -104.71 166.36 10.44 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.031 0.932 . . . . 0.0 110.451 178.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.408 ' HB3' HD12 ' A' ' 76' ' ' LEU . 65.2 m-85 -136.08 129.65 32.2 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.883 1.273 . . . . 0.0 108.722 -179.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.73 133.93 50.77 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.584 0.753 . . . . 0.0 111.023 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.453 ' HB3' HD23 ' A' ' 76' ' ' LEU . 54.2 t80 -129.13 116.61 19.49 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.533 1.133 . . . . 0.0 108.292 171.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.5 t70 59.05 30.47 20.28 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.492 1.117 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 87.68 -19.78 31.25 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 113.37 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.8 m -65.29 120.14 12.21 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.621 0.768 . . . . 0.0 110.494 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -68.88 113.52 6.38 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.453 HD23 ' HB3' ' A' ' 71' ' ' PHE . 31.7 mt -82.62 119.44 24.28 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -85.94 -31.02 22.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.366 1.066 . . . . 0.0 112.315 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.7 10.49 23.04 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.803 -172.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -123.54 10.46 9.12 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.538 1.135 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -112.45 148.08 35.15 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.7 mt -102.21 156.65 34.98 Favored Pre-proline 0 C--N 1.313 -0.991 0 C-N-CA 125.37 1.468 . . . . 0.0 107.767 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.422 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.5 Cg_endo -67.57 -21.43 46.03 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.407 1.405 . . . . 0.0 110.894 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.2 76.25 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.017 0.927 . . . . 0.0 110.719 170.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.08 -42.35 89.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.016 0.926 . . . . 0.0 111.431 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.8 mt -74.18 -24.47 59.38 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 76.37 68.7 1.49 Allowed Glycine 0 C--N 1.351 1.374 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -173.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.487 ' SD ' HD13 ' A' ' 28' ' ' LEU . 43.8 ttm -118.65 160.19 22.26 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.47 1.108 . . . . 0.0 109.8 -172.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -124.03 166.14 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.275 0.63 . . . . 0.0 109.986 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 t -76.63 15.22 0.66 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.172 0.989 . . . . 0.0 113.174 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -151.94 55.98 0.45 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -103.71 -175.05 2.69 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.033 -173.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.4 tp -143.84 107.38 4.61 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.5 mt -94.22 150.09 4.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.903 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -105.6 158.25 16.82 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.431 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.2 t -136.87 124.46 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -124.82 99.27 6.07 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.618 0.767 . . . . 0.0 109.695 -176.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 177.005 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.77 0.319 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -99.35 -37.04 9.4 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.984 0.913 . . . . 0.0 109.246 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.5 t -110.39 121.53 45.52 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 169.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.0 m -81.85 70.2 8.7 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -79.5 -38.84 33.47 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 162.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -124.97 151.64 45.22 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 114.475 -1.239 . . . . 0.0 109.307 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.6 mt -107.32 134.84 49.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.918 1.287 . . . . 0.0 108.626 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -83.06 101.36 11.08 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.545 HD11 ' SD ' ' A' ' 87' ' ' MET . 90.3 mt -110.51 124.21 51.38 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.956 0.502 . . . . 0.0 111.225 -170.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -87.68 138.12 31.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.188 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.57 124.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 125.238 1.415 . . . . 0.0 108.103 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -122.97 129.05 51.05 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -175.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.645 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -74.74 172.86 52.58 Favored Glycine 0 C--N 1.342 0.877 0 N-CA-C 114.739 0.656 . . . . 0.0 114.739 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.474 ' HZ2' ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -36.03 -39.89 0.18 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.129 1.372 . . . . 0.0 112.453 157.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -81.67 99.12 8.72 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -68.04 -22.45 64.96 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -171.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -70.18 -28.73 65.55 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.904 0.882 . . . . 0.0 110.523 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -71.9 112.63 8.16 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.205 0.602 . . . . 0.0 109.401 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 39.8 m -128.04 126.32 41.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.737 0.815 . . . . 0.0 108.894 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -128.01 136.86 51.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -125.23 128.27 48.04 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.055 0.843 . . . . 0.0 110.272 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -133.96 144.25 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.451 1.1 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.2 m -94.14 107.23 19.17 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.525 ' HB3' HD12 ' A' ' 28' ' ' LEU . 43.1 tp -93.48 134.97 35.18 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.009 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.3 m -77.68 141.2 39.52 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.1 ptm180 -63.4 -26.05 68.57 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.15 -15.98 24.15 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.784 0.834 . . . . 0.0 110.621 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.0 m -88.74 132.84 37.28 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.479 ' O ' HG23 ' A' ' 51' ' ' THR . 1.0 OUTLIER -69.0 163.61 37.0 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.484 2.122 . . . . 0.0 113.359 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.52 HD12 ' HE3' ' A' ' 87' ' ' MET . 4.1 mm? -57.26 -26.37 60.69 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.882 177.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.403 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 59.5 pttt -58.62 -36.89 74.78 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.479 HG23 ' O ' ' A' ' 48' ' ' PRO . 6.3 t -72.56 -30.42 64.4 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-O 120.924 0.392 . . . . 0.0 110.661 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -71.7 -40.32 69.59 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.262 1.025 . . . . 0.0 110.304 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.477 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 63.4 mtt -56.37 -43.88 79.63 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.234 1.013 . . . . 0.0 110.462 173.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.0 t -64.1 -41.61 97.21 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 124.955 1.409 . . . . 0.0 109.837 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -66.91 -46.01 76.16 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.221 0.608 . . . . 0.0 110.962 -174.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.12 -60.85 2.91 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.699 0.8 . . . . 0.0 111.692 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.2 pt-20 -59.55 -40.6 87.83 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.91 0.757 . . . . 0.0 111.786 -176.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -64.97 -40.26 94.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.8 86.45 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.674 0.789 . . . . 0.0 112.388 -179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.724 ' HG3' HD23 ' A' ' 62' ' ' LEU . 20.0 ptp -110.02 27.95 9.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.439 0.695 . . . . 0.0 112.145 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 34.99 66.9 0.31 Allowed Glycine 0 CA--C 1.54 1.6 0 N-CA-C 116.621 1.409 . . . . 0.0 116.621 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.724 HD23 ' HG3' ' A' ' 60' ' ' MET . 2.0 mm? -89.83 69.57 7.57 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.749 0.785 . . . . 0.0 110.177 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.6 p -100.9 109.19 21.11 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.618 176.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.93 -83.4 0.23 Allowed Glycine 0 C--N 1.341 0.824 0 N-CA-C 110.377 -1.089 . . . . 0.0 110.377 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -82.35 134.21 35.25 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -105.73 154.28 20.68 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -128.67 155.39 45.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.813 0.845 . . . . 0.0 111.144 -168.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.468 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 56.4 m -104.49 169.09 8.67 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.138 0.975 . . . . 0.0 109.885 176.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.409 ' HB2' ' HE1' ' A' ' 53' ' ' MET . 18.4 m-85 -130.73 132.19 45.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.266 1.027 . . . . 0.0 109.0 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -127.76 121.87 31.35 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.852 0.861 . . . . 0.0 111.023 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.528 ' HB3' HD22 ' A' ' 76' ' ' LEU . 42.7 t80 -102.43 109.79 21.55 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 52.92 40.9 31.75 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.385 1.074 . . . . 0.0 111.087 -171.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 73.94 4.23 66.53 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 114.838 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 94.4 m -81.24 120.88 25.46 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.77 0.785 . . . . 0.0 109.185 173.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.468 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 3.1 tmtp? -69.42 113.12 6.44 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.528 HD22 ' HB3' ' A' ' 71' ' ' PHE . 33.5 mt -83.64 116.66 22.73 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.8 m -71.66 -27.31 62.98 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.844 0.858 . . . . 0.0 111.4 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 127.97 -44.38 1.24 Allowed Glycine 0 C--N 1.346 1.103 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.376 -177.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -80.47 -1.22 40.75 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -171.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -76.25 148.31 37.7 Favored 'General case' 0 C--N 1.347 0.467 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -102.87 149.86 37.22 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.998 1.319 . . . . 0.0 107.779 174.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.429 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 53.5 Cg_endo -66.5 -25.78 47.77 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 121.575 1.517 . . . . 0.0 111.298 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.21 96.99 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.664 0.786 . . . . 0.0 111.133 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.05 -43.48 74.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.761 0.825 . . . . 0.0 111.221 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 76.7 mt -72.17 -19.82 61.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.716 0.806 . . . . 0.0 111.757 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.94 51.24 5.93 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.545 ' SD ' HD11 ' A' ' 28' ' ' LEU . 41.7 ttm -106.36 156.55 18.4 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.831 1.252 . . . . 0.0 109.137 -174.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.9 tt0 -139.47 160.06 40.71 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.004 0.521 . . . . 0.0 110.89 -170.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.7 m -61.85 117.78 6.33 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.232 0.613 . . . . 0.0 110.333 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.15 48.77 4.47 Favored Glycine 0 C--N 1.338 0.676 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.6 t0 -102.87 -160.89 0.81 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.8 tp -142.75 109.79 5.57 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.624 0.726 . . . . 0.0 109.042 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.476 HD12 HD11 ' A' ' 28' ' ' LEU . 45.2 mt -101.0 148.35 7.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 167.448 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -115.56 162.02 17.8 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.645 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 24.6 t -138.41 103.92 2.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -113.02 108.21 17.02 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.238 0.615 . . . . 0.0 110.206 -174.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.957 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 178.603 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.4 m . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -31.54 11.65 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.681 0.792 . . . . 0.0 110.466 -176.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.0 t -91.04 114.56 27.12 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -81.15 70.58 8.01 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -167.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -80.93 -38.91 27.05 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 159.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -128.16 147.42 50.56 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 124.877 1.271 . . . . 0.0 108.947 165.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -117.3 151.84 36.12 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.09 1.356 . . . . 0.0 108.729 -174.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -99.19 103.96 15.88 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 91' ' ' ASP . 2.2 mm? -100.56 127.91 46.78 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.49 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 93.1 mtt180 -92.5 105.14 17.37 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.164 0.586 . . . . 0.0 110.25 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -99.37 118.24 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.155 -172.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.446 ' NE2' HD12 ' A' ' 92' ' ' LEU . 26.7 mt-30 -125.6 128.26 47.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.013 0.525 . . . . 0.0 110.58 -170.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.65 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -82.02 162.86 42.99 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 123.58 0.55 . . . . 0.0 113.625 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -58.7 -17.08 19.72 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.884 0.874 . . . . 0.0 112.371 168.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -74.48 132.97 42.35 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -64.45 -34.18 77.6 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -169.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -99.31 16.19 23.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.295 0.638 . . . . 0.0 111.695 178.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -99.26 95.63 7.2 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.117 0.484 . . . . 0.0 110.386 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.9 m -127.43 129.86 48.26 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 166.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.519 HD23 ' HE3' ' A' ' 60' ' ' MET . 14.1 tp -130.64 152.34 50.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.49 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.7 pt-20 -133.04 132.29 41.65 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 164.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -134.25 148.57 29.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 123.779 0.832 . . . . 0.0 109.662 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 m -92.08 109.4 20.76 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.275 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.474 ' HB3' HD23 ' A' ' 28' ' ' LEU . 56.7 tp -105.75 133.08 51.06 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.925 177.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -77.44 146.64 36.4 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.534 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 15.0 ptm180 -66.57 -20.76 66.09 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.324 0.65 . . . . 0.0 112.161 -174.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.75 -18.51 22.84 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.399 1.08 . . . . 0.0 110.899 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.0 m -93.5 126.1 51.43 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 123.712 0.805 . . . . 0.0 109.542 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.447 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 9.9 Cg_endo -65.98 164.41 27.45 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.138 1.892 . . . . 0.0 113.826 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.471 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -59.94 -25.92 65.55 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.106 -177.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.447 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 65.0 pttt -57.34 -38.03 73.47 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 48' ' ' PRO . 14.3 t -70.45 -31.31 68.42 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 117.819 0.281 . . . . 0.0 110.53 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -69.47 -42.12 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.231 1.012 . . . . 0.0 110.276 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -56.96 -44.89 83.05 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.424 1.089 . . . . 0.0 110.505 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.8 m -67.56 -39.14 84.93 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 113.89 -1.505 . . . . 0.0 110.134 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -65.17 -45.87 83.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.968 0.507 . . . . 0.0 110.164 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -55.9 -60.36 3.58 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.78 1.232 . . . . 0.0 111.722 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.77 -38.09 86.72 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.584 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -65.9 -35.32 80.31 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 121.868 -0.52 . . . . 0.0 111.89 175.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.97 -42.29 99.79 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.461 0.704 . . . . 0.0 112.798 -177.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.519 ' HE3' HD23 ' A' ' 39' ' ' LEU . 4.5 mpp? -106.46 28.64 7.6 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.099 0.56 . . . . 0.0 111.543 179.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 43.89 38.78 4.67 Favored Glycine 0 N--CA 1.478 1.492 0 N-CA-C 116.355 1.302 . . . . 0.0 116.355 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.4 mt -81.88 67.93 8.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.186 0.994 . . . . 0.0 108.69 175.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.8 m -98.5 128.95 45.06 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.314 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.55 -53.2 2.71 Favored Glycine 0 C--N 1.344 0.975 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -172.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -74.59 93.79 2.56 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 168.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -90.72 141.9 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 166.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.09 160.42 29.11 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.601 1.16 . . . . 0.0 109.638 -173.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.438 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.0 m -87.11 159.89 18.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.377 0.671 . . . . 0.0 111.241 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.83 129.14 40.06 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -128.87 143.1 50.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.03 0.932 . . . . 0.0 111.69 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.547 ' HB3' HD21 ' A' ' 76' ' ' LEU . 16.2 t80 -133.67 104.32 6.29 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.914 1.685 . . . . 0.0 107.845 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t70 55.18 30.45 14.54 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 122.519 1.152 . . . . 0.0 111.841 -174.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 88.3 -3.66 85.42 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 114.94 -1.027 . . . . 0.0 113.679 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.0 m -75.54 113.94 13.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.442 0.697 . . . . 0.0 109.596 174.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -66.88 113.59 5.05 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 173.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.547 HD21 ' HB3' ' A' ' 71' ' ' PHE . 38.8 mt -78.94 112.19 15.88 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.252 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.0 m -78.95 -26.65 43.56 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.94 0.896 . . . . 0.0 112.672 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.04 -45.73 1.1 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.618 -178.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.16 4.83 44.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 111.431 -164.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.484 ' HG3' HD22 ' A' ' 85' ' ' LEU . 1.2 pm0 -91.75 147.99 22.58 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.5 mt -98.2 156.21 36.09 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 125.71 1.604 . . . . 0.0 109.108 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.534 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 54.6 Cg_endo -66.76 -23.95 47.79 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 121.546 1.498 . . . . 0.0 111.485 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 -37.52 68.81 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.677 0.791 . . . . 0.0 111.188 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -62.63 -42.47 99.61 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.805 0.842 . . . . 0.0 110.48 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.484 HD22 ' HG3' ' A' ' 80' ' ' GLU . 76.8 mt -79.25 -24.0 43.3 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.81 0.844 . . . . 0.0 111.348 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 73.64 64.8 2.38 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 -175.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 70.2 mtp -106.87 170.85 7.7 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.9 0.88 . . . . 0.0 110.391 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -126.83 169.51 13.15 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.958 0.903 . . . . 0.0 109.954 -177.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -75.1 11.78 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.787 0.835 . . . . 0.0 112.503 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -148.58 46.77 0.67 Allowed Glycine 0 C--N 1.34 0.797 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.523 ' HB3' HD12 ' A' ' 28' ' ' LEU . 7.2 t70 -93.04 176.64 6.34 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.446 HD12 ' NE2' ' A' ' 31' ' ' GLN . 28.6 tp -131.4 118.88 20.87 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -172.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 44.6 mt -106.63 147.24 12.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 170.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -124.54 155.67 38.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -175.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.65 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 11.6 t -135.12 126.76 46.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 123.343 0.657 . . . . 0.0 109.242 -171.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -130.56 94.74 3.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.246 1.018 . . . . 0.0 109.395 -174.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.127 0 CA-C-O 118.328 -1.262 . . . . 0.0 110.893 176.399 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -140.61 -47.5 0.42 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.246 0.218 . . . . 0.0 110.56 172.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -114.24 79.27 1.24 Allowed 'General case' 0 C--O 1.243 0.73 0 C-N-CA 124.038 0.935 . . . . 0.0 109.136 162.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -100.95 66.28 1.15 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 122.291 1.043 . . . . 0.0 110.914 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -81.72 -39.52 24.11 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 114.086 -1.415 . . . . 0.0 107.219 150.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.521 ' NE2' ' HB2' ' A' ' 42' ' ' SER . 19.4 pt20 -130.45 153.07 49.16 Favored 'General case' 0 C--N 1.349 0.555 0 CA-C-N 113.968 -1.469 . . . . 0.0 110.126 -176.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.515 HD13 ' HB2' ' A' ' 82' ' ' PRO . 57.5 mt -110.59 135.11 51.73 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.778 1.231 . . . . 0.0 108.577 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -90.8 103.84 16.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 35.3 mt -109.65 132.97 53.65 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.185 -0.322 . . . . 0.0 110.329 -171.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -95.2 140.68 29.78 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -129.7 132.37 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -173.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -135.84 141.94 44.74 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.065 0.393 . . . . 0.0 110.866 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.639 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -81.15 172.28 53.96 Favored Glycine 0 C--N 1.347 1.141 0 O-C-N 123.683 0.615 . . . . 0.0 113.306 177.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -41.38 -32.23 0.3 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 124.628 1.171 . . . . 0.0 112.729 165.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.471 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 0.8 OUTLIER -94.79 113.81 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 163.635 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -67.87 -20.26 65.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.087 0.555 . . . . 0.0 112.151 -173.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -63.36 -27.88 69.61 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.825 0.85 . . . . 0.0 110.528 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.471 ' HB2' ' HG2' ' A' ' 34' ' ' GLU . 5.3 tp-100 -76.43 87.75 3.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.6 m -119.02 130.25 55.56 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.094 0.558 . . . . 0.0 110.77 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.57 121.16 18.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.33 1.052 . . . . 0.0 108.204 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -105.11 116.23 31.59 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -123.6 144.95 31.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 123.992 0.917 . . . . 0.0 110.251 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.521 ' HB2' ' NE2' ' A' ' 25' ' ' GLN . 25.8 p -91.19 110.02 21.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 44.6 tp -109.59 134.16 52.26 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.735 0.814 . . . . 0.0 108.813 177.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 57.4 m -73.57 142.77 46.62 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 176.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.505 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 35.5 ptt180 -62.49 -27.64 69.28 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.2 0.6 . . . . 0.0 112.13 -173.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -95.92 -9.94 30.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.729 0.811 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.42 ' OG ' ' HB2' ' A' ' 44' ' ' SER . 66.4 m -90.13 139.67 27.24 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 123.681 0.793 . . . . 0.0 109.443 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.576 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 7.2 Cg_exo -65.88 157.45 59.06 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.872 2.381 . . . . 0.0 113.093 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.6 mm? -58.11 -27.8 64.06 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.519 173.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.576 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 61.2 pttt -58.09 -38.07 75.7 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.604 0.638 . . . . 0.0 112.608 -177.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.47 HG22 ' O ' ' A' ' 48' ' ' PRO . 13.2 t -72.49 -29.39 63.6 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 120.817 0.341 . . . . 0.0 110.454 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 tt -69.72 -42.52 73.9 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.885 0.874 . . . . 0.0 110.099 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -56.9 -46.86 81.64 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.344 1.058 . . . . 0.0 110.51 177.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.7 t -64.36 -35.57 81.32 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.404 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -68.7 -46.32 69.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.381 0.672 . . . . 0.0 110.216 -178.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -57.39 -60.15 4.08 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.359 1.064 . . . . 0.0 111.823 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.15 -32.81 73.46 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.84 0.712 . . . . 0.0 111.787 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -73.44 -38.54 65.48 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.23 -50.06 75.45 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.724 0.81 . . . . 0.0 112.669 -175.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.621 ' HG3' HD23 ' A' ' 62' ' ' LEU . 17.9 ptp -100.08 30.51 3.73 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.467 -176.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 46.18 36.63 7.4 Favored Glycine 0 CA--C 1.536 1.363 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.621 HD23 ' HG3' ' A' ' 60' ' ' MET . 3.9 mm? -86.3 9.92 16.38 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.251 0.621 . . . . 0.0 110.571 170.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 p -59.99 102.35 0.16 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.15 0.98 . . . . 0.0 110.262 172.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.37 -57.66 0.71 Allowed Glycine 0 C--N 1.347 1.156 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -88.72 98.49 11.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -85.2 141.83 29.87 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.257 0.48 . . . . 0.0 110.587 -178.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.6 158.88 36.3 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.321 1.048 . . . . 0.0 110.127 -175.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 21.3 m -86.57 162.32 18.07 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.406 0.683 . . . . 0.0 111.243 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -131.22 126.76 36.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.394 1.078 . . . . 0.0 109.152 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.408 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 9.6 m-85 -123.44 151.29 42.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.618 0.767 . . . . 0.0 110.762 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.554 ' HB3' HD21 ' A' ' 76' ' ' LEU . 22.2 t80 -137.25 114.11 10.52 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 172.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.8 25.68 15.21 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.794 0.838 . . . . 0.0 110.824 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 78.03 4.46 86.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.561 -174.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.0 m -82.82 120.2 25.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.785 0.834 . . . . 0.0 109.066 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tmtp? -68.12 115.29 7.44 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.554 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.4 mt -81.97 112.06 18.71 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.0 t -71.87 -34.22 69.03 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.767 0.827 . . . . 0.0 111.979 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.86 -9.43 11.43 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 116.009 -0.541 . . . . 0.0 113.356 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -109.82 10.97 24.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.476 ' HG3' HD22 ' A' ' 85' ' ' LEU . 1.4 pm0 -101.74 147.92 25.89 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -98.86 156.26 35.74 Favored Pre-proline 0 C--N 1.312 -1.023 0 C-N-CA 125.183 1.393 . . . . 0.0 108.683 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.515 ' HB2' HD13 ' A' ' 26' ' ' LEU . 49.4 Cg_endo -65.38 -33.02 49.15 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.799 1.666 . . . . 0.0 111.072 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.16 79.64 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.848 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.49 -42.93 77.95 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.935 0.894 . . . . 0.0 111.683 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.476 HD22 ' HG3' ' A' ' 80' ' ' GLU . 85.0 mt -70.95 -22.98 62.15 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.447 0.699 . . . . 0.0 111.293 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 99.06 17.67 26.79 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.724 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.3 mtt -71.06 166.9 20.41 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.777 0.831 . . . . 0.0 111.627 177.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -166.19 2.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.197 0.999 . . . . 0.0 109.67 175.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.7 m -78.64 12.83 1.87 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -165.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -162.09 63.23 0.27 Allowed Glycine 0 C--N 1.352 1.426 0 CA-C-N 118.245 0.475 . . . . 0.0 112.22 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.44 -168.65 1.72 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.693 0.397 . . . . 0.0 110.038 -170.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.3 tp -139.83 127.5 21.78 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.827 0.851 . . . . 0.0 109.23 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.4 mt -121.2 152.63 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.935 1.294 . . . . 0.0 108.448 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.408 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 30.8 mt-10 -114.04 160.73 18.56 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.793 1.237 . . . . 0.0 107.899 -173.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.639 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 9.4 t -137.26 107.88 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.85 0.86 . . . . 0.0 109.034 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -105.29 94.76 5.4 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.218 1.007 . . . . 0.0 108.656 -176.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.464 0 CA-C-O 118.547 -1.141 . . . . 0.0 111.773 -178.035 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -99.5 -43.57 6.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.23 0.612 . . . . 0.0 110.908 -175.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.9 t -110.48 92.43 4.04 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-O 121.824 0.821 . . . . 0.0 110.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -101.85 70.25 1.23 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.409 0.684 . . . . 0.0 109.786 170.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -74.6 -60.24 2.37 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 170.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.464 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 4.3 pp0? -119.97 142.7 48.53 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 167.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.73 125.21 49.38 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.149 1.38 . . . . 0.0 109.437 -166.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -80.07 100.53 8.24 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 176.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.7 mt -114.13 128.86 56.57 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.767 0.427 . . . . 0.0 110.049 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -95.33 132.05 40.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 93' ' ' ILE . 2.8 t -123.17 129.42 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -174.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 37' ' ' GLN . 28.6 mt-30 -129.55 130.59 45.95 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -175.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.578 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -82.31 -173.8 49.26 Favored Glycine 0 C--N 1.346 1.11 0 O-C-N 123.368 0.417 . . . . 0.0 113.335 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -30.96 -45.9 0.08 Allowed 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 124.947 1.299 . . . . 0.0 112.392 161.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.95 113.33 21.32 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 167.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -70.2 -19.78 63.15 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.475 0.31 . . . . 0.0 110.555 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.04 -33.32 75.49 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 124.06 0.944 . . . . 0.0 110.371 170.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.448 ' O ' ' HA ' ' A' ' 31' ' ' GLN . 7.0 tp-100 -68.71 87.33 0.34 Allowed 'General case' 0 C--N 1.352 0.68 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 172.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m -109.44 112.75 25.04 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -128.0 113.53 15.95 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 -170.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -106.74 121.98 45.45 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -172.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -132.01 147.11 32.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.854 0.862 . . . . 0.0 110.832 -171.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.8 m -90.9 111.62 23.13 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.248 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.488 HD21 HD22 ' A' ' 49' ' ' LEU . 29.2 tp -114.62 121.24 42.81 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.254 0.621 . . . . 0.0 109.523 175.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 21.3 m -75.16 149.13 39.09 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.537 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 30.6 ptt180 -69.94 -13.47 62.26 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -99.42 -19.62 16.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.498 0.719 . . . . 0.0 109.665 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.463 ' HB3' HG23 ' A' ' 51' ' ' THR . 58.0 m -85.54 133.4 42.15 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.197 0.999 . . . . 0.0 109.597 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.443 ' O ' HG22 ' A' ' 51' ' ' THR . 3.3 Cg_exo -71.77 159.42 50.75 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.488 HD22 HD21 ' A' ' 43' ' ' LEU . 2.7 mm? -53.85 -30.69 46.66 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.06 1.344 . . . . 0.0 111.774 177.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -39.76 58.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.007 0.923 . . . . 0.0 112.935 177.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.463 HG23 ' HB3' ' A' ' 47' ' ' SER . 2.5 t -69.72 -33.12 72.04 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 120.87 0.367 . . . . 0.0 110.888 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.85 -38.68 73.17 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.254 1.021 . . . . 0.0 110.455 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -59.01 -42.77 90.93 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.818 0.847 . . . . 0.0 110.192 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -61.62 -42.51 98.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.709 1.256 . . . . 0.0 110.827 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -68.96 -44.73 72.37 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.316 0.647 . . . . 0.0 110.922 -174.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -58.13 -54.05 51.35 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.304 1.042 . . . . 0.0 111.61 176.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.59 -41.62 96.13 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.593 0.558 . . . . 0.0 110.641 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -57.56 -44.37 85.21 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.765 0.426 . . . . 0.0 111.657 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -57.17 7.33 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -103.52 33.06 3.51 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 117.791 0.269 . . . . 0.0 111.555 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.62 49.7 26.73 Favored Glycine 0 CA--C 1.537 1.447 0 N-CA-C 116.59 1.396 . . . . 0.0 116.59 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -90.88 20.15 5.03 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.024 0.929 . . . . 0.0 111.06 169.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.4 p -68.07 85.1 0.24 Allowed 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.628 0.771 . . . . 0.0 110.401 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.61 -41.32 1.24 Allowed Glycine 0 C--N 1.346 1.124 0 C-N-CA 124.043 0.83 . . . . 0.0 111.17 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -100.65 103.26 14.53 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.893 0.877 . . . . 0.0 109.025 175.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -87.55 143.12 27.36 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 120.849 0.357 . . . . 0.0 110.752 -178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.451 ' N ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.19 153.29 47.06 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.408 1.083 . . . . 0.0 109.951 -175.216 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.1 m -83.22 156.79 22.98 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.85 0.86 . . . . 0.0 111.209 -176.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -125.51 128.95 48.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.678 1.191 . . . . 0.0 108.84 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -131.35 139.41 49.51 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.65 0.78 . . . . 0.0 111.033 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -131.59 111.72 11.97 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.429 1.492 . . . . 0.0 108.266 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 53.88 30.36 11.39 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.801 1.241 . . . . 0.0 112.044 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 92.07 -19.01 51.96 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.712 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.2 m -70.79 137.69 49.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.932 0.893 . . . . 0.0 110.665 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -89.41 117.24 28.19 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.41 109.34 13.68 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -79.24 -28.83 42.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.641 0.776 . . . . 0.0 111.457 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.65 -52.04 0.66 Allowed Glycine 0 C--N 1.348 1.201 0 C-N-CA 122.994 0.33 . . . . 0.0 113.327 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.0 mtp-105 -85.6 2.12 46.35 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.916 0.886 . . . . 0.0 113.315 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.521 ' HG3' HD22 ' A' ' 85' ' ' LEU . 1.1 pm0 -85.71 148.82 25.69 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 38.5 mt -100.4 151.35 37.53 Favored Pre-proline 0 C--N 1.316 -0.885 0 C-N-CA 124.957 1.303 . . . . 0.0 108.614 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.537 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 57.5 Cg_endo -65.51 -35.05 40.42 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 121.966 1.777 . . . . 0.0 111.232 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' A' ' 45' ' ' ARG . . . -60.26 -33.84 72.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.971 0.909 . . . . 0.0 111.151 173.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -73.8 -44.67 55.17 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.539 0.735 . . . . 0.0 110.72 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.521 HD22 ' HG3' ' A' ' 80' ' ' GLU . 26.5 mt -66.9 -24.53 66.12 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.217 0.607 . . . . 0.0 110.817 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 88.77 51.79 2.96 Favored Glycine 0 C--N 1.345 1.079 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -175.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.2 mtp -112.82 165.33 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.408 1.083 . . . . 0.0 109.946 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -153.6 166.45 32.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.142 0.977 . . . . 0.0 108.839 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.3 m -54.59 111.8 0.88 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.568 0.747 . . . . 0.0 110.052 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.98 -28.79 3.3 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.045 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.48 168.21 1.66 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.8 tp -130.26 109.04 10.47 Favored 'General case' 0 C--N 1.349 0.555 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -168.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 30' ' ' VAL . 38.7 mt -92.06 152.2 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 171.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -124.06 165.16 17.97 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 -178.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.578 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 14.8 t -137.06 133.61 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -137.48 131.79 32.36 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.319 1.048 . . . . 0.0 108.745 -170.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.15 0 CA-C-O 118.795 -1.003 . . . . 0.0 112.37 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 p . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -99.48 -45.67 5.74 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.425 0.69 . . . . 0.0 109.82 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.1 t -101.05 79.58 2.03 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.47 1.128 . . . . 0.0 108.615 175.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.411 ' O ' ' HD3' ' A' ' 45' ' ' ARG . 32.4 m -87.21 130.62 34.49 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.341 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -59.95 -48.67 80.74 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.512 0.725 . . . . 0.0 109.24 173.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.557 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 3.2 pp0? -126.46 144.99 50.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.803 173.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -116.06 150.41 37.34 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.03 1.332 . . . . 0.0 107.504 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -99.82 103.32 14.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.526 HD11 ' HB3' ' A' ' 91' ' ' ASP . 1.8 mm? -101.16 126.97 47.91 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -91.48 105.28 17.65 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.387 0.675 . . . . 0.0 109.768 -176.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.33 123.82 52.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.041 0.937 . . . . 0.0 108.695 -173.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -130.69 138.19 49.91 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.816 0.446 . . . . 0.0 110.491 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.608 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -75.75 174.12 52.95 Favored Glycine 0 C--N 1.347 1.154 0 O-C-N 123.684 0.615 . . . . 0.0 113.185 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -45.61 -33.28 2.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.132 0.573 . . . . 0.0 111.153 164.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -77.78 110.33 12.56 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.615 ' HZ2' ' HB3' ' A' ' 35' ' ' LYS . 0.5 OUTLIER -69.67 -25.15 63.76 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -170.205 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -85.74 -9.87 56.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.888 0.475 . . . . 0.0 111.314 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -77.29 87.71 3.71 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 167.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.4 m -122.66 132.68 54.38 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.167 0.987 . . . . 0.0 109.493 -172.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.5 tp -131.97 154.35 49.4 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 173.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.1 132.53 44.91 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 167.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -131.0 146.39 34.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 123.613 0.765 . . . . 0.0 109.521 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.3 p -90.86 105.94 18.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.493 ' HB3' HD22 ' A' ' 28' ' ' LEU . 66.6 tp -107.34 130.72 54.75 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.919 176.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.557 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 41.9 t -75.62 152.32 37.65 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.611 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 31.6 ptt180 -69.13 -13.38 62.39 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.479 0.712 . . . . 0.0 111.746 179.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -99.13 -23.67 15.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.919 0.888 . . . . 0.0 109.882 177.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 133.04 50.88 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.63 0.772 . . . . 0.0 110.305 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.471 ' O ' HG22 ' A' ' 51' ' ' THR . 6.1 Cg_exo -69.64 158.6 56.54 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.833 2.355 . . . . 0.0 113.271 178.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.3 mm? -58.35 -25.79 62.38 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.742 1.217 . . . . 0.0 112.04 177.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.402 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.51 -39.16 75.9 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.223 0.609 . . . . 0.0 112.387 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -72.38 -29.53 63.85 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 120.897 0.38 . . . . 0.0 110.778 -178.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -70.39 -41.45 72.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.037 0.935 . . . . 0.0 110.314 172.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.464 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 63.8 mtt -55.02 -49.72 70.85 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.994 0.918 . . . . 0.0 110.835 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 p -67.06 -38.35 85.65 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.972 1.42 . . . . 0.0 109.627 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -64.64 -48.79 73.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.024 0.53 . . . . 0.0 110.288 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -56.29 -59.08 5.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.088 0.955 . . . . 0.0 111.837 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.554 ' HA ' HD22 ' A' ' 62' ' ' LEU . 15.8 pt-20 -62.31 -31.64 72.28 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.027 0.83 . . . . 0.0 112.55 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -70.72 -46.42 63.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.434 0.294 . . . . 0.0 111.789 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.21 -50.6 45.86 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.55 0.74 . . . . 0.0 112.451 -173.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 59.2 tpp -85.97 25.45 1.13 Allowed 'General case' 0 CA--C 1.572 1.825 0 C-N-CA 124.472 1.109 . . . . 0.0 111.322 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.56 47.88 29.06 Favored Glycine 0 C--N 1.356 1.641 0 N-CA-C 116.633 1.413 . . . . 0.0 116.633 177.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.554 HD22 ' HA ' ' A' ' 57' ' ' GLU . 3.9 mm? -83.14 15.53 2.81 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 117.416 0.608 . . . . 0.0 112.455 179.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -62.7 91.35 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.489 0.716 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.08 -42.35 0.56 Allowed Glycine 0 C--N 1.347 1.16 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.382 -176.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -124.96 134.22 52.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.87 0.868 . . . . 0.0 109.527 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -100.79 134.94 43.01 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 168.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.503 HD13 ' HG ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -123.17 159.82 27.81 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.945 0.898 . . . . 0.0 111.038 -164.989 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 160.27 14.76 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.289 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -124.68 131.79 53.44 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.011 0.924 . . . . 0.0 109.37 -177.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -134.06 116.92 16.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.388 1.075 . . . . 0.0 110.534 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -97.41 109.76 22.45 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.6 t70 51.8 40.57 28.01 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.052 0.93 . . . . 0.0 111.02 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 72.71 6.27 66.42 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 114.982 -1.008 . . . . 0.0 114.575 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -87.84 116.99 26.38 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.97 0.908 . . . . 0.0 109.57 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -67.16 113.84 5.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.425 0.453 . . . . 0.0 110.232 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -80.65 123.69 28.37 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.7 m -75.09 -30.12 60.82 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.768 0.827 . . . . 0.0 110.716 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.91 -38.32 2.27 Favored Glycine 0 C--N 1.345 1.034 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.219 -175.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -87.55 2.56 50.44 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -170.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.52 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -89.54 147.71 23.8 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 172.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.2 mt -97.21 158.08 33.84 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 125.119 1.368 . . . . 0.0 108.261 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.611 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 62.0 Cg_endo -66.29 -27.56 47.95 Favored 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 110.781 176.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.69 -37.12 81.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.594 0.757 . . . . 0.0 110.707 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -68.65 -41.33 79.5 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.789 0.835 . . . . 0.0 110.647 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.52 HD21 ' HG3' ' A' ' 80' ' ' GLU . 84.5 mt -75.54 -24.12 56.7 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.074 0.95 . . . . 0.0 112.17 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.99 58.56 3.18 Favored Glycine 0 C--N 1.346 1.091 0 O-C-N 123.371 0.419 . . . . 0.0 112.22 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.8 mtp -102.83 171.0 7.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.115 0.966 . . . . 0.0 110.079 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.4 tt0 -137.23 157.57 46.35 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.068 0.547 . . . . 0.0 110.876 -178.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.3 p -59.28 111.1 1.23 Allowed 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 168.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 94.8 42.23 3.9 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.889 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.526 ' HB3' HD11 ' A' ' 28' ' ' LEU . 2.4 t70 -97.53 -171.57 2.22 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 177.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 35.7 tp -137.03 135.48 37.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.261 0.625 . . . . 0.0 109.5 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.4 mt -127.34 148.92 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.66 154.36 39.48 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -173.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.608 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.8 t -133.7 121.93 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -125.91 96.77 4.87 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.407 1.083 . . . . 0.0 109.566 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.218 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.352 -179.027 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 20.1 p . . . . . 0 N--CA 1.478 0.944 0 CA-C-O 120.782 0.325 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.32 -46.67 5.19 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 168.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -112.56 105.76 14.04 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 105.761 -1.941 . . . . 0.0 105.761 158.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 t -85.5 67.24 10.04 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.549 0.69 . . . . 0.0 111.147 -170.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -83.34 -39.46 20.7 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 152.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.434 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -91.44 153.68 19.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.563 -177.094 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -116.77 151.01 37.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.698 1.599 . . . . 0.0 109.323 -177.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -103.06 109.78 21.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 171.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.479 HD22 ' HB3' ' A' ' 43' ' ' LEU . 1.1 mm? -112.24 139.63 47.62 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.3 mtp85 -92.76 112.83 24.93 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.493 0.717 . . . . 0.0 110.546 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.28 113.5 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.499 1.12 . . . . 0.0 108.665 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -126.29 133.59 51.37 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -172.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.56 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -84.07 169.91 46.68 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.718 0.636 . . . . 0.0 112.556 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -55.32 -15.6 2.66 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 173.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -86.96 140.06 29.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.248 0.619 . . . . 0.0 109.547 172.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -65.1 -35.2 80.37 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.319 0.648 . . . . 0.0 110.996 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -67.48 -36.95 82.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.316 0.647 . . . . 0.0 110.511 177.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -74.87 85.87 2.23 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.445 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.3 m -123.12 126.79 47.7 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.274 1.03 . . . . 0.0 108.411 172.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.412 ' HG ' ' HE1' ' A' ' 60' ' ' MET . 1.6 tm? -139.85 142.38 36.59 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -133.71 136.61 44.77 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -140.2 151.71 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 123.919 0.887 . . . . 0.0 109.989 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -92.13 108.67 20.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.424 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.479 ' HB3' HD22 ' A' ' 28' ' ' LEU . 31.2 tp -105.21 131.47 52.64 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.531 1.132 . . . . 0.0 109.178 175.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 44.7 m -76.84 151.65 35.79 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.514 0.509 . . . . 0.0 109.654 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.563 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 12.8 ptm180 -67.53 -18.69 65.12 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.257 0.551 . . . . 0.0 110.949 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -92.92 -30.93 15.14 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.138 1.375 . . . . 0.0 109.77 -175.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.6 m -88.34 140.63 30.34 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.21 1.004 . . . . 0.0 110.35 -176.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.476 ' HA ' HD21 ' A' ' 81' ' ' LEU . 6.8 Cg_exo -67.78 157.66 60.76 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.221 2.614 . . . . 0.0 113.408 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.46 ' HB3' ' HE1' ' A' ' 53' ' ' MET . 3.9 mm? -51.79 -32.35 30.88 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.061 1.344 . . . . 0.0 112.068 173.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.453 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -58.88 -35.88 73.72 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.638 0.775 . . . . 0.0 112.593 -177.351 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.47 HG23 ' O ' ' A' ' 48' ' ' PRO . 4.3 t -67.7 -33.69 75.39 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.93 -40.78 68.52 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.532 1.133 . . . . 0.0 110.607 175.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.46 ' HE1' ' HB3' ' A' ' 49' ' ' LEU . 64.9 mtt -58.83 -46.33 87.92 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.072 0.949 . . . . 0.0 110.865 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 p -68.18 -28.06 66.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.48 1.112 . . . . 0.0 110.799 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -71.31 -47.7 55.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.323 0.649 . . . . 0.0 110.322 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.26 -58.83 5.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.38 1.072 . . . . 0.0 111.905 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.514 ' HA ' HD23 ' A' ' 62' ' ' LEU . 6.7 pt-20 -59.52 -31.04 69.02 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 124.018 0.823 . . . . 0.0 112.427 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.47 -43.06 70.56 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.61 -54.68 29.81 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -174.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.412 ' HE1' ' HG ' ' A' ' 39' ' ' LEU . 2.5 mpp? -106.86 34.58 3.37 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 122.392 0.277 . . . . 0.0 111.494 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 46.09 48.41 14.74 Favored Glycine 0 N--CA 1.474 1.184 0 N-CA-C 116.92 1.528 . . . . 0.0 116.92 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 57' ' ' GLU . 2.5 mm? -81.74 21.6 0.82 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.37 0.668 . . . . 0.0 112.407 177.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.9 p -70.28 123.75 22.46 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.301 0.64 . . . . 0.0 110.766 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 130.38 -77.96 0.39 Allowed Glycine 0 C--N 1.35 1.322 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -87.46 116.05 25.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 171.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -80.25 150.14 30.14 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.441 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -127.67 149.98 49.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.296 1.038 . . . . 0.0 109.7 -177.409 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -93.3 158.69 15.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.424 0.69 . . . . 0.0 110.732 -175.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.431 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 48.1 m-85 -124.32 127.83 48.21 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.432 1.093 . . . . 0.0 109.375 -176.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.25 129.76 49.57 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.082 0.953 . . . . 0.0 110.195 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.485 ' HB3' HD21 ' A' ' 76' ' ' LEU . 51.6 t80 -108.02 109.41 20.86 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.77 27.08 16.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.557 1.143 . . . . 0.0 111.391 -172.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.55 -2.11 88.26 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.055 -0.521 . . . . 0.0 113.852 -175.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.8 m -79.01 122.56 26.34 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -67.87 117.64 10.02 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.485 HD21 ' HB3' ' A' ' 71' ' ' PHE . 21.5 mt -92.29 120.34 32.74 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.2 t -77.47 -23.02 50.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.264 0.626 . . . . 0.0 110.965 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.99 -38.64 2.99 Favored Glycine 0 C--N 1.344 0.991 0 C-N-CA 123.043 0.354 . . . . 0.0 113.286 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.7 mtp180 -76.41 -14.98 60.04 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.558 0.743 . . . . 0.0 112.849 -171.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.24 149.02 44.94 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 173.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 48' ' ' PRO . 21.8 mt -99.13 157.21 34.46 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 125.161 1.384 . . . . 0.0 107.302 176.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.563 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.1 Cg_endo -65.54 -17.02 56.3 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 121.466 1.444 . . . . 0.0 111.39 178.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.78 93.38 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.747 0.819 . . . . 0.0 111.006 170.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -68.01 -45.62 73.54 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.107 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 79.5 mt -74.24 -15.0 61.01 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.616 0.766 . . . . 0.0 112.561 -176.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.67 35.73 27.86 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.153 0.283 . . . . 0.0 112.991 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.496 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 60.5 mtp -90.22 166.4 13.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.169 0.988 . . . . 0.0 110.855 -177.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -153.81 166.38 33.07 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.3 t -61.51 112.05 2.05 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.888 0.475 . . . . 0.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 130.5 -27.63 3.92 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.814 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.418 ' HB2' HD13 ' A' ' 28' ' ' LEU . 1.8 m-20 -58.08 172.72 0.4 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.2 tp -133.83 113.94 12.8 Favored 'General case' 0 C--N 1.352 0.682 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.393 -163.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.418 HD12 ' HE3' ' A' ' 87' ' ' MET . 39.4 mt -100.39 149.17 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 172.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.431 ' O ' ' HA ' ' A' ' 69' ' ' PHE . 36.5 mt-10 -112.96 158.38 20.31 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -172.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.56 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.1 t -135.15 118.73 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -111.31 106.17 15.04 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.277 1.431 . . . . 0.0 109.033 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.447 0 CA-C-O 118.55 -1.139 . . . . 0.0 111.572 179.263 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 CA--C 1.55 0.973 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -141.16 -49.25 0.41 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 118.458 0.572 . . . . 0.0 111.312 172.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.4 p -113.36 81.23 1.47 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.329 0.652 . . . . 0.0 112.446 -177.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 p -100.96 66.18 1.14 Allowed 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.504 1.145 . . . . 0.0 108.792 166.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.657 ' HG3' ' HG2' ' A' ' 25' ' ' GLN . 7.6 pt20 -84.55 -49.48 8.56 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 113.799 -1.546 . . . . 0.0 109.986 164.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.657 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 4.8 mm-40 -103.53 156.68 17.59 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.224 1.01 . . . . 0.0 110.692 -171.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 82.8 mt -91.55 129.67 37.5 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.587 -174.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -89.17 102.73 15.38 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.596 HD21 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mm? -106.19 122.02 45.35 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -89.79 124.36 34.59 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.328 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.83 117.17 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.223 1.009 . . . . 0.0 109.54 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -127.01 130.92 50.96 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.965 0.906 . . . . 0.0 108.579 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.473 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -93.11 170.31 31.56 Favored Glycine 0 C--N 1.339 0.698 0 O-C-N 123.753 0.658 . . . . 0.0 113.596 -173.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.0 ptmm? -58.15 -12.48 3.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.91 0.884 . . . . 0.0 112.007 163.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -77.19 107.66 9.73 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 105.478 -2.045 . . . . 0.0 105.478 164.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -63.99 -19.92 65.51 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -165.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -99.76 -8.1 24.67 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.929 0.492 . . . . 0.0 111.714 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -69.6 88.85 0.52 Allowed 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.158 0.583 . . . . 0.0 110.345 178.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -106.41 107.84 19.05 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 171.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' ' HE2' ' A' ' 60' ' ' MET . 1.7 tm? -131.2 137.47 48.97 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -178.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -132.01 141.57 49.3 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.056 0.455 . . . . 0.0 109.878 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.33 152.6 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.119 0.968 . . . . 0.0 109.84 178.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -91.71 110.78 22.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.596 ' HB3' HD21 ' A' ' 28' ' ' LEU . 32.2 tp -102.85 136.66 42.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.465 0.706 . . . . 0.0 109.824 176.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 34.0 t -76.29 143.88 40.62 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.521 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.1 ptm180 -60.58 -29.41 69.17 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.986 0.914 . . . . 0.0 112.835 -175.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -110.57 3.06 19.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.532 0.733 . . . . 0.0 111.977 -178.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.404 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 70.1 m -93.47 134.04 27.33 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 170.385 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.539 ' O ' HG23 ' A' ' 51' ' ' THR . 2.8 Cg_exo -65.95 155.69 68.21 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.753 2.302 . . . . 0.0 112.784 -176.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -53.54 -27.53 26.54 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.982 1.313 . . . . 0.0 112.322 176.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.492 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.69 -37.98 74.39 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.759 0.824 . . . . 0.0 112.949 179.555 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 48' ' ' PRO . 7.3 t -67.3 -33.31 75.02 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.348 0.594 . . . . 0.0 110.359 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.36 -41.06 66.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.961 1.304 . . . . 0.0 110.442 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.477 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.2 mtt -55.05 -44.03 74.34 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.93 0.892 . . . . 0.0 110.915 176.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -67.26 -35.38 79.39 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -71.53 -46.76 58.7 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.909 0.484 . . . . 0.0 110.777 -175.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -54.09 -57.46 11.0 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.811 0.845 . . . . 0.0 111.743 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.494 ' HA ' HD23 ' A' ' 62' ' ' LEU . 7.7 pt-20 -60.1 -31.83 70.41 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.894 0.746 . . . . 0.0 111.768 -177.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.51 -36.75 76.75 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 173.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.87 -52.87 59.08 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.442 ' HE2' ' HG ' ' A' ' 39' ' ' LEU . 3.3 mpp? -106.39 27.24 8.93 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.446 0.298 . . . . 0.0 110.941 178.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 40.12 53.65 3.25 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 116.46 1.344 . . . . 0.0 116.46 -179.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.6 mm? -68.45 70.9 0.18 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.679 1.192 . . . . 0.0 112.367 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.3 m -101.47 116.36 32.59 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.09 0.956 . . . . 0.0 108.771 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 115.28 -78.58 0.27 Allowed Glycine 0 C--N 1.346 1.111 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -70.45 104.92 2.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 171.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -101.11 148.34 25.18 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -126.75 157.66 38.56 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.659 0.784 . . . . 0.0 111.728 -166.328 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 31.8 m -113.32 156.57 23.14 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.306 1.042 . . . . 0.0 109.803 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.497 ' CE1' HD21 ' A' ' 67' ' ' LEU . 38.9 m-85 -122.61 128.2 50.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.659 0.784 . . . . 0.0 110.041 -172.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.454 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 60.7 m-85 -127.44 139.32 52.9 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.868 0.867 . . . . 0.0 110.783 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -116.24 107.08 14.41 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 51.19 41.42 27.73 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 122.093 0.949 . . . . 0.0 111.244 -172.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.55 -8.22 66.02 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 115.032 -0.985 . . . . 0.0 114.949 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.8 m -74.51 115.58 14.21 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.225 0.61 . . . . 0.0 109.719 178.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.48 114.06 4.59 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.01 109.12 16.06 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.6 m -69.48 -28.11 65.79 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.089 0.955 . . . . 0.0 111.005 -176.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.52 -49.5 0.9 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.385 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -87.42 10.83 16.22 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.628 0.771 . . . . 0.0 112.967 -170.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 mp0 -83.87 148.13 27.14 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 173.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 30.3 mt -101.26 152.05 37.86 Favored Pre-proline 0 C--N 1.309 -1.182 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 176.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.521 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 59.1 Cg_endo -64.36 -35.66 49.14 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.687 1.591 . . . . 0.0 110.989 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.52 -30.55 70.25 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.164 0.586 . . . . 0.0 110.8 175.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -71.87 -45.16 62.31 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.805 0.842 . . . . 0.0 111.592 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.418 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 54.6 mt -69.91 -24.94 63.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.49 0.716 . . . . 0.0 111.487 -176.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.0 45.92 3.48 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 -173.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.418 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 63.3 mtp -104.76 163.97 12.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.158 0.983 . . . . 0.0 108.99 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -135.07 178.37 7.08 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 -176.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 30.0 p -74.19 19.22 0.13 Allowed 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -176.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.09 61.14 0.3 Allowed Glycine 0 C--N 1.344 0.985 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 172.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.457 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -111.12 -177.49 3.22 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.568 0.747 . . . . 0.0 109.399 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 37.6 tp -137.52 114.78 10.94 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 109.913 -167.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 43.1 mt -98.11 150.91 4.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 113.956 -1.474 . . . . 0.0 108.563 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 41.9 mt-10 -106.14 152.86 22.89 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 -175.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.473 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.6 t -130.63 109.44 16.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -115.93 96.36 5.55 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.156 0.982 . . . . 0.0 109.835 -174.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.256 0 CA-C-O 118.855 -0.97 . . . . 0.0 111.708 177.259 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.1 m . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.68 -176.0 4.14 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.226 1.01 . . . . 0.0 111.746 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.6 p -60.99 101.79 0.17 Allowed 'General case' 0 C--N 1.354 0.771 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 165.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 99.49 3.61 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.975 -170.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.472 ' HG2' ' HG3' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -67.67 -27.95 67.28 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.275 0.63 . . . . 0.0 110.145 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 40.4 mt-30 -126.74 143.01 51.37 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 170.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.412 HD12 ' HB2' ' A' ' 82' ' ' PRO . 56.2 mt -107.84 129.27 55.08 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.187 1.395 . . . . 0.0 109.173 -177.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -84.25 103.12 13.18 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -112.27 132.49 54.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.034 0.534 . . . . 0.0 110.336 -175.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -91.2 110.59 21.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.169 0.987 . . . . 0.0 109.021 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HE2' ' A' ' 69' ' ' PHE . 2.2 t -105.78 124.72 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -177.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -135.5 145.14 46.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 118.099 0.409 . . . . 0.0 110.359 -173.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.578 ' HA3' HE21 ' A' ' 37' ' ' GLN . . . -83.54 176.01 52.41 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.374 0.421 . . . . 0.0 112.538 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -42.54 -27.33 0.16 Allowed 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.332 1.053 . . . . 0.0 113.428 166.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -104.22 123.59 47.6 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 165.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -71.75 -11.04 60.63 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.178 0.591 . . . . 0.0 111.624 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -62.53 -40.99 98.53 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.299 0.64 . . . . 0.0 109.552 169.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.578 HE21 ' HA3' ' A' ' 32' ' ' GLY . 25.9 tt0 -75.18 90.41 2.55 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.275 172.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 m -121.76 140.66 52.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.901 0.88 . . . . 0.0 110.192 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.2 tp -138.3 127.39 24.16 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 167.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -103.17 113.03 26.18 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 175.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.95 151.17 23.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 123.828 0.851 . . . . 0.0 110.435 -172.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -92.49 109.23 20.62 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 171.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.434 ' HB2' HD11 ' A' ' 52' ' ' LEU . 23.6 tp -105.82 125.53 51.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.25 0.62 . . . . 0.0 109.381 172.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 58.6 m -73.18 144.34 46.87 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.484 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 26.4 ptt180 -62.54 -26.51 68.61 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.876 0.87 . . . . 0.0 112.398 -173.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -99.56 -11.7 20.78 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.783 0.833 . . . . 0.0 111.029 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.4 m -92.34 136.77 25.19 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 123.743 0.817 . . . . 0.0 109.381 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.539 ' O ' HG23 ' A' ' 51' ' ' THR . 3.7 Cg_exo -71.41 161.69 44.75 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.796 2.331 . . . . 0.0 113.781 -176.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.488 HD13 ' HE2' ' A' ' 87' ' ' MET . 3.8 mm? -53.83 -31.4 49.14 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 125.241 1.416 . . . . 0.0 112.242 175.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -32.71 72.42 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -70.18 -33.26 71.51 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 118.113 0.415 . . . . 0.0 111.036 174.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.434 HD11 ' HB2' ' A' ' 43' ' ' LEU . 6.3 tt -68.94 -39.31 79.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.1 0.96 . . . . 0.0 110.126 173.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.3 mtt -59.01 -42.73 90.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.327 1.051 . . . . 0.0 110.09 175.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 t -68.02 -40.28 82.97 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.259 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -66.63 -48.2 70.2 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 120.952 0.406 . . . . 0.0 110.569 -174.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -55.18 -53.46 55.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.005 1.322 . . . . 0.0 112.213 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.83 -46.62 84.26 Favored 'General case' 0 CA--C 1.558 1.253 0 O-C-N 124.154 0.908 . . . . 0.0 110.908 -179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.38 -45.54 84.36 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.241 0.616 . . . . 0.0 111.994 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.77 83.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.074 0.95 . . . . 0.0 112.935 -178.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.2 mtm -102.34 33.54 3.09 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.084 0.554 . . . . 0.0 111.827 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.36 35.37 14.95 Favored Glycine 0 CA--C 1.537 1.425 0 N-CA-C 117.492 1.757 . . . . 0.0 117.492 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -94.3 42.01 1.09 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.02 0.928 . . . . 0.0 108.75 167.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.9 m -67.67 112.33 4.72 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.066 0.946 . . . . 0.0 111.458 -175.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 19.28 65.79 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.204 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -139.91 78.01 1.64 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.826 1.25 . . . . 0.0 107.794 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.513 ' HZ2' ' HB3' ' A' ' 66' ' ' LYS . 7.2 ttpm? -80.07 135.63 36.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.654 0.74 . . . . 0.0 110.54 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.19 160.29 14.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.38 1.472 . . . . 0.0 108.213 177.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.577 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 21.1 m -76.95 144.46 38.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.407 0.283 . . . . 0.0 110.892 -174.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.443 ' HE2' HG11 ' A' ' 30' ' ' VAL . 49.2 m-85 -120.26 125.85 49.13 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.894 0.877 . . . . 0.0 109.892 179.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -125.13 133.08 52.97 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.266 1.026 . . . . 0.0 110.094 177.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.438 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.1 t80 -124.46 114.56 19.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.219 1.008 . . . . 0.0 108.538 174.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.14 27.83 15.58 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.593 1.157 . . . . 0.0 111.368 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.84 -8.17 76.98 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.314 -0.857 . . . . 0.0 113.828 -177.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 96.7 m -73.76 119.86 18.56 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.114 0.566 . . . . 0.0 110.272 176.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -68.07 113.5 5.79 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.438 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.3 mt -82.03 116.84 21.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.7 m -73.37 -31.65 64.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.656 0.782 . . . . 0.0 111.155 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.8 -48.65 0.96 Allowed Glycine 0 C--N 1.343 0.923 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.296 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.5 mtp85 -86.45 9.72 17.34 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -169.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -84.66 147.54 26.89 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 166.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.16 161.96 26.41 Favored Pre-proline 0 C--N 1.313 -0.981 0 C-N-CA 124.541 1.136 . . . . 0.0 108.566 174.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.484 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 60.8 Cg_endo -66.23 -30.29 46.07 Favored 'Trans proline' 0 C--N 1.368 1.581 0 C-N-CA 121.429 1.419 . . . . 0.0 110.812 174.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.4 80.12 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.053 0.941 . . . . 0.0 111.032 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -69.54 -48.78 59.25 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.016 0.927 . . . . 0.0 111.841 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.453 HD13 ' HE1' ' A' ' 87' ' ' MET . 87.9 mt -71.83 -20.8 61.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.433 0.693 . . . . 0.0 111.397 -177.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.92 15.66 51.29 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.455 0.472 . . . . 0.0 112.456 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.488 ' HE2' HD13 ' A' ' 49' ' ' LEU . 57.9 mtm -76.54 160.09 29.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.326 0.65 . . . . 0.0 110.869 177.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -160.82 166.64 28.24 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.712 1.205 . . . . 0.0 107.981 -170.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.1 m -61.04 106.08 0.55 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 118.029 0.377 . . . . 0.0 110.519 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 136.56 -32.73 2.43 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.032 -0.531 . . . . 0.0 113.219 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.7 170.81 0.07 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.4 tp -132.16 109.28 9.85 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -168.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 51.6 mt -95.94 147.96 5.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.567 -1.272 . . . . 0.0 107.567 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -124.06 161.76 24.89 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -172.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.525 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.7 t -140.06 128.04 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.844 0.858 . . . . 0.0 110.418 -169.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.577 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 55.9 m95 -106.11 97.88 7.64 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 171.028 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -175.349 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.04 -45.18 61.79 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -138.67 120.84 15.76 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.788 176.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -84.57 101.08 11.83 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -70.21 -29.75 66.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 121.592 0.711 . . . . 0.0 109.334 174.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? -139.15 139.88 37.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.524 1.13 . . . . 0.0 108.69 166.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.5 mp -110.23 147.95 32.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.23 1.412 . . . . 0.0 108.431 -172.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -102.14 104.73 15.35 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.502 HD22 ' HB3' ' A' ' 43' ' ' LEU . 1.9 mm? -104.65 135.85 45.28 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -175.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -90.59 128.94 36.75 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.94 123.21 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -172.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -134.01 141.06 47.09 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.016 0.371 . . . . 0.0 110.564 -173.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.633 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -76.47 175.37 53.1 Favored Glycine 0 C--N 1.342 0.894 0 O-C-N 123.871 0.732 . . . . 0.0 112.323 177.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -39.52 -37.35 0.47 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.719 0.807 . . . . 0.0 110.815 161.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -84.29 113.98 21.52 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 171.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.559 ' HZ2' ' HB3' ' A' ' 35' ' ' LYS . 0.4 OUTLIER -64.66 -32.64 74.4 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.066 0.547 . . . . 0.0 112.349 -177.304 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -69.99 -22.66 63.11 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.391 0.677 . . . . 0.0 110.885 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -78.18 89.32 4.26 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.971 0.908 . . . . 0.0 108.647 174.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.0 m -125.98 137.0 53.65 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.603 0.761 . . . . 0.0 111.267 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.3 tp -136.3 136.29 39.63 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -119.54 122.85 42.55 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.0 p -128.76 149.45 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 123.935 0.894 . . . . 0.0 110.562 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 p -92.93 108.94 20.39 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.502 ' HB3' HD22 ' A' ' 28' ' ' LEU . 28.1 tp -103.91 134.33 47.38 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.456 1.102 . . . . 0.0 109.494 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.9 t -79.0 145.72 33.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.601 ' HB2' ' HB3' ' A' ' 83' ' ' ALA . 33.6 ptt180 -68.41 -13.51 62.35 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.753 0.421 . . . . 0.0 112.041 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -97.65 -21.71 16.88 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.115 0.966 . . . . 0.0 109.91 177.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.6 m -88.38 134.75 33.85 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.489 ' O ' HG22 ' A' ' 51' ' ' THR . 5.4 Cg_exo -71.11 163.39 39.36 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 122.71 2.273 . . . . 0.0 112.968 178.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.475 ' O ' ' HG3' ' A' ' 53' ' ' MET . 2.6 mm? -60.65 -22.94 64.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.479 1.112 . . . . 0.0 111.655 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -56.94 -38.29 72.72 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.302 0.641 . . . . 0.0 112.166 178.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.6 t -71.0 -28.77 64.66 Favored 'General case' 0 C--N 1.355 0.84 0 CA-C-O 120.862 0.363 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -74.58 -41.11 61.08 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 110.359 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -55.43 -48.93 73.68 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.785 0.834 . . . . 0.0 111.051 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.7 p -70.41 -33.63 71.58 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 113.868 -1.515 . . . . 0.0 109.61 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.11 -52.7 46.25 Favored 'General case' 0 C--N 1.354 0.787 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -55.84 -60.7 3.09 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 123.829 0.852 . . . . 0.0 111.506 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.43 -38.11 79.81 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.792 0.682 . . . . 0.0 112.749 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.66 -29.07 61.11 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.35 -50.33 9.03 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.087 0.555 . . . . 0.0 111.804 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 59.6 tpp -72.8 -22.91 60.74 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.428 1.091 . . . . 0.0 111.419 -172.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.04 35.39 4.25 Favored Glycine 0 C--N 1.354 1.583 0 O-C-N 122.128 -0.358 . . . . 0.0 113.23 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.16 123.65 40.99 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.055 0.942 . . . . 0.0 110.337 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.5 t -156.9 169.13 25.49 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 124.788 1.235 . . . . 0.0 108.971 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.82 -66.63 3.81 Favored Glycine 0 C--N 1.349 1.251 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -96.01 130.55 42.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.22 1.008 . . . . 0.0 109.331 170.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -99.75 144.18 29.12 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.457 ' N ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -116.55 155.16 29.16 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.029 0.932 . . . . 0.0 110.998 -167.866 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 71.1 m -91.58 163.51 14.1 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.99 -178.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 35.4 m-85 -129.02 130.45 46.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.319 1.048 . . . . 0.0 108.968 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -130.44 129.02 42.46 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.726 0.81 . . . . 0.0 111.485 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -119.2 111.99 18.93 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.632 1.573 . . . . 0.0 107.673 172.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 51.56 40.69 27.61 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.065 0.936 . . . . 0.0 112.011 -177.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 81.54 -19.28 9.14 Favored Glycine 0 N--CA 1.478 1.457 0 CA-C-N 115.012 -0.994 . . . . 0.0 114.589 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.7 m -71.23 116.03 11.07 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.458 0.703 . . . . 0.0 109.919 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -70.87 113.69 8.18 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.33 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.22 116.23 13.51 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 m -74.06 -35.68 64.29 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.153 0.981 . . . . 0.0 111.886 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.15 -56.25 0.51 Allowed Glycine 0 C--N 1.347 1.165 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.925 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -89.77 10.29 24.06 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -167.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.476 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.9 OUTLIER -86.43 148.46 25.55 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 175.415 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.1 mt -101.39 149.84 36.69 Favored Pre-proline 0 C--N 1.315 -0.92 0 C-N-CA 124.993 1.317 . . . . 0.0 109.18 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.564 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 56.7 Cg_endo -66.13 -24.79 51.4 Favored 'Trans proline' 0 C--N 1.377 2.073 0 C-N-CA 122.07 1.846 . . . . 0.0 111.44 179.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.601 ' HB3' ' HB2' ' A' ' 45' ' ' ARG . . . -60.64 -47.45 86.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.813 0.845 . . . . 0.0 110.267 170.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -71.17 -32.68 69.2 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.808 -175.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.476 HD21 ' HG3' ' A' ' 80' ' ' GLU . 72.9 mt -75.63 -23.04 56.3 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.551 0.74 . . . . 0.0 111.175 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.41 52.62 4.72 Favored Glycine 0 C--N 1.344 1.026 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 -175.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 71.5 mtp -97.58 174.87 6.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.678 0.791 . . . . 0.0 110.148 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.489 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 38.6 tt0 -133.99 155.8 49.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.241 0.616 . . . . 0.0 110.576 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 p -63.05 115.19 4.21 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 165.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.54 52.63 3.3 Favored Glycine 0 C--N 1.342 0.879 0 N-CA-C 111.613 -0.595 . . . . 0.0 111.613 -169.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t70 -110.07 -159.46 0.68 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.4 tp -142.93 143.54 32.04 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.865 0.841 . . . . 0.0 110.576 -175.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.2 mt -139.3 150.78 22.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 C-N-CA 126.472 1.909 . . . . 0.0 106.734 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -121.68 168.04 12.24 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 109.625 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.633 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 44.0 t -142.41 105.3 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 -174.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -114.75 94.9 4.97 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.736 0.779 . . . . 0.0 109.636 -175.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.581 0 CA-C-N 114.119 -1.4 . . . . 0.0 110.306 -179.169 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.4 m . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.77 -41.59 6.82 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 174.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -111.26 120.36 41.99 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -66.41 86.86 0.11 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.403 0.681 . . . . 0.0 112.368 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.41 -48.54 16.95 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -131.02 154.56 48.07 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 124.437 1.095 . . . . 0.0 108.569 174.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.471 HD12 ' HB2' ' A' ' 82' ' ' PRO . 77.2 mt -108.21 125.98 52.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.886 1.274 . . . . 0.0 109.53 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.53 102.92 14.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 42.4 mt -110.39 131.44 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.08 0.552 . . . . 0.0 109.75 -173.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.409 ' O ' HD13 ' A' ' 92' ' ' LEU . 64.4 mtt85 -94.3 109.94 21.72 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.518 0.727 . . . . 0.0 109.213 -178.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -101.13 127.63 54.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.427 ' HG2' HG21 ' A' ' 38' ' ' THR . 70.8 mt-30 -134.45 153.1 52.1 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -177.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.541 ' HA3' HE21 ' A' ' 37' ' ' GLN . . . -90.97 -177.77 43.58 Favored Glycine 0 N--CA 1.463 0.435 0 O-C-N 123.399 0.437 . . . . 0.0 112.766 175.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -48.43 -16.45 0.11 Allowed 'General case' 0 CA--C 1.562 1.435 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 164.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.08 135.39 55.2 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.623 1.169 . . . . 0.0 109.225 172.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.93 -14.02 61.37 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.354 0.662 . . . . 0.0 112.127 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -64.15 -35.03 79.44 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 173.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.541 HE21 ' HA3' ' A' ' 32' ' ' GLY . 28.4 tt0 -90.07 87.04 6.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.679 173.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.427 HG21 ' HG2' ' A' ' 31' ' ' GLN . 90.7 m -129.33 141.5 51.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.715 0.806 . . . . 0.0 109.829 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 tp -142.59 144.66 32.96 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.585 1.154 . . . . 0.0 108.158 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -120.22 115.68 24.09 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.42 150.05 27.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 123.936 0.894 . . . . 0.0 110.134 -170.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.7 m -92.21 108.57 20.05 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.4 ' HB2' HD11 ' A' ' 52' ' ' LEU . 26.7 tp -105.54 123.59 48.15 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.216 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.2 m -72.87 147.71 45.11 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -177.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.34 -27.69 68.68 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.955 0.902 . . . . 0.0 112.482 -171.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -101.07 -12.05 19.15 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.549 0.739 . . . . 0.0 111.006 -178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.417 ' HB3' HG21 ' A' ' 51' ' ' THR . 67.7 m -83.82 134.8 43.66 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 123.293 0.637 . . . . 0.0 109.819 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.57 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 2.7 Cg_exo -67.78 158.01 59.19 Favored 'Trans proline' 0 C--N 1.368 1.554 0 C-N-CA 122.707 2.271 . . . . 0.0 113.122 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.591 HD13 ' HE2' ' A' ' 87' ' ' MET . 4.0 mm? -54.24 -30.78 51.43 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.782 1.233 . . . . 0.0 111.974 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.57 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.57 -34.37 69.13 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.468 HG23 ' O ' ' A' ' 48' ' ' PRO . 2.8 t -71.77 -33.01 68.27 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 120.862 0.363 . . . . 0.0 110.936 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.4 HD11 ' HB2' ' A' ' 43' ' ' LEU . 4.3 tt -68.43 -41.76 79.89 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.539 1.135 . . . . 0.0 110.356 173.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.5 -48.31 81.22 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.189 0.995 . . . . 0.0 109.74 176.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 t -63.1 -38.73 92.36 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 113.998 -1.455 . . . . 0.0 110.901 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -63.02 -50.1 72.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.004 0.522 . . . . 0.0 110.06 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.471 ' CE2' HG21 ' A' ' 95' ' ' VAL . 48.2 t80 -55.82 -57.03 13.74 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.558 1.143 . . . . 0.0 112.389 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -65.77 -42.5 90.77 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.374 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -63.8 -38.22 90.28 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.85 -52.59 63.5 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.753 0.821 . . . . 0.0 113.098 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.5 mtm -102.17 35.73 2.32 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 122.939 0.496 . . . . 0.0 111.683 -175.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 49.27 37.52 24.59 Favored Glycine 0 C--N 1.348 1.196 0 N-CA-C 117.586 1.794 . . . . 0.0 117.586 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -90.84 36.0 0.9 Allowed 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 117.68 0.74 . . . . 0.0 109.923 167.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 m -65.19 104.82 0.97 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.799 0.84 . . . . 0.0 110.109 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.8 -36.97 3.94 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 111.481 -0.648 . . . . 0.0 111.481 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -88.55 78.48 7.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.694 0.798 . . . . 0.0 109.18 177.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -79.59 144.64 33.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.589 0.356 . . . . 0.0 110.37 -176.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.424 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -120.91 157.19 30.4 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.89 1.276 . . . . 0.0 108.95 -178.917 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.416 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 17.4 m -77.23 153.06 34.4 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.859 0.463 . . . . 0.0 111.089 -176.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -125.61 125.61 43.41 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.084 0.954 . . . . 0.0 109.317 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -124.86 143.67 50.71 Favored 'General case' 0 C--O 1.212 -0.881 0 C-N-CA 124.001 0.92 . . . . 0.0 109.973 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -118.91 105.48 11.53 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.6 t70 55.76 28.33 12.11 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 124.145 0.978 . . . . 0.0 111.691 -170.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.04 1.5 79.38 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.692 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.3 m -79.1 119.62 22.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.474 0.71 . . . . 0.0 109.413 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.65 114.01 8.31 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.6 mt -83.4 126.69 33.0 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -83.38 -34.44 25.57 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.507 0.723 . . . . 0.0 111.845 -175.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.99 -60.87 0.56 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.57 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 57.3 mtp85 -84.02 5.96 23.84 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -169.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.467 ' HG3' HD22 ' A' ' 85' ' ' LEU . 2.6 pm0 -76.31 147.86 37.9 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 170.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -100.1 162.7 20.15 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 124.424 1.09 . . . . 0.0 108.883 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.471 ' HB2' HD12 ' A' ' 26' ' ' LEU . 62.9 Cg_endo -66.8 -23.51 48.05 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 121.606 1.537 . . . . 0.0 111.01 174.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.97 -32.95 73.72 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.919 0.887 . . . . 0.0 111.244 171.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.61 -47.63 21.73 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.723 0.809 . . . . 0.0 110.922 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.467 HD22 ' HG3' ' A' ' 80' ' ' GLU . 77.3 mt -72.13 -15.29 61.98 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.32 0.648 . . . . 0.0 111.404 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.36 28.36 55.82 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.529 0.518 . . . . 0.0 112.534 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.591 ' HE2' HD13 ' A' ' 49' ' ' LEU . 66.2 mtm -84.36 168.21 15.8 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.72 0.808 . . . . 0.0 111.593 177.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HA ' HD11 ' A' ' 26' ' ' LEU . 40.2 tt0 -155.87 169.3 24.73 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.715 1.206 . . . . 0.0 108.367 -177.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 m -57.39 112.25 1.35 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.26 0.624 . . . . 0.0 110.911 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 122.71 -14.21 8.6 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-O 119.624 -0.542 . . . . 0.0 113.629 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.49 170.46 1.02 Allowed 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 175.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 29' ' ' ARG . 43.9 tp -132.61 111.7 11.43 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.877 -169.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 56.8 mt -100.63 152.31 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.525 1.13 . . . . 0.0 108.182 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -115.45 163.33 15.88 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.687 1.195 . . . . 0.0 108.741 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.503 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 22.3 t -136.97 110.1 8.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 124.465 1.106 . . . . 0.0 108.994 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.8 m95 -108.77 93.62 4.62 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.943 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 -177.002 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 121.027 0.441 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -100.1 -44.52 5.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.05 0.94 . . . . 0.0 110.044 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 65.9 p -101.74 121.29 41.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.1 m -73.68 70.3 1.35 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 122.208 1.004 . . . . 0.0 112.363 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -80.75 -38.27 28.96 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.026 1.33 . . . . 0.0 108.328 169.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.572 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 10.4 pt20 -113.88 151.28 32.41 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.3 -1.318 . . . . 0.0 109.019 171.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.406 HD12 ' HB2' ' A' ' 82' ' ' PRO . 53.5 mt -114.29 128.91 56.58 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.47 1.508 . . . . 0.0 109.448 177.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.23 105.17 17.28 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.05 135.66 52.41 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.822 0.849 . . . . 0.0 109.831 -169.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.59 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 81.6 mtt180 -95.38 111.99 23.78 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.823 0.849 . . . . 0.0 110.313 -177.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.17 129.97 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.987 0.915 . . . . 0.0 109.874 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -131.05 146.67 52.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.76 0.824 . . . . 0.0 108.923 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.607 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -86.49 -177.02 49.61 Favored Glycine 0 N--CA 1.466 0.693 0 C-N-CA 121.603 -0.332 . . . . 0.0 113.138 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.6 mtpt -29.66 -46.14 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 125.394 1.478 . . . . 0.0 112.649 159.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -88.49 114.74 25.42 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -71.98 -20.28 61.75 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.11 0.564 . . . . 0.0 111.847 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -68.47 -27.63 66.33 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.022 0.529 . . . . 0.0 110.225 170.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -74.27 87.6 1.98 Allowed 'General case' 0 C--N 1.354 0.779 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.7 m -115.63 136.57 52.93 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.64 0.776 . . . . 0.0 110.172 -172.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -137.12 151.15 48.52 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.869 1.268 . . . . 0.0 107.582 173.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.59 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.0 pt-20 -131.3 126.35 35.13 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -135.23 147.72 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.798 -172.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.8 m -92.77 110.81 22.26 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.57 0.748 . . . . 0.0 109.042 -178.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 32.7 tp -110.26 130.79 55.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.328 1.051 . . . . 0.0 109.594 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.572 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 20.8 t -75.41 145.76 41.32 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.58 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.63 -21.36 65.62 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -172.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -106.17 -7.86 17.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.905 0.882 . . . . 0.0 111.849 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.9 m -90.37 134.54 30.97 Favored Pre-proline 0 CA--C 1.543 0.689 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.522 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 8.1 Cg_exo -63.5 155.35 63.09 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.899 2.4 . . . . 0.0 113.403 -178.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.0 mm? -53.28 -30.36 38.2 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 124.561 1.145 . . . . 0.0 111.874 173.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.522 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.85 -37.05 73.17 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.077 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.492 HG21 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -68.52 -33.47 74.17 Favored 'General case' 0 CA--C 1.561 1.367 0 CA-C-O 121.053 0.454 . . . . 0.0 110.759 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 tt -70.61 -38.33 73.97 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.718 1.207 . . . . 0.0 110.177 173.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 62.2 mtt -60.5 -40.02 89.85 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.212 1.005 . . . . 0.0 111.155 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -65.49 -38.44 89.75 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.477 1.111 . . . . 0.0 110.182 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -67.33 -47.55 70.16 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.611 0.364 . . . . 0.0 110.409 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.5 -55.83 27.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.406 0.682 . . . . 0.0 111.677 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.52 -38.15 88.85 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 123.674 0.609 . . . . 0.0 112.149 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -66.81 -47.75 71.07 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.569 0.348 . . . . 0.0 111.612 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.76 -48.48 74.4 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.113 0.965 . . . . 0.0 112.185 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.417 ' HB3' HD23 ' A' ' 62' ' ' LEU . 35.8 tpp -81.55 17.32 1.44 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 124.217 1.007 . . . . 0.0 112.431 -171.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 55.71 26.87 47.88 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 -176.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.417 HD23 ' HB3' ' A' ' 60' ' ' MET . 3.6 mm? -85.76 22.48 1.63 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.051 0.94 . . . . 0.0 111.747 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.5 p -72.38 87.55 1.16 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.765 0.826 . . . . 0.0 110.381 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.54 -48.76 0.09 OUTLIER Glycine 0 C--N 1.343 0.95 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.756 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -132.68 134.63 45.06 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.124 0.969 . . . . 0.0 108.753 177.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -83.58 138.7 33.26 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 176.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.451 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -116.98 156.98 26.53 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.622 1.169 . . . . 0.0 109.921 -171.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.497 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 74.9 m -99.39 175.08 5.98 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.498 0.719 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -141.51 139.03 33.18 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.448 1.099 . . . . 0.0 109.553 -163.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -123.28 143.45 50.05 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.0 0.92 . . . . 0.0 110.664 174.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.51 ' HB3' HD21 ' A' ' 76' ' ' LEU . 66.4 t80 -129.6 106.12 8.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 171.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.12 26.94 16.8 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.445 1.098 . . . . 0.0 110.761 -170.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 90.55 -13.12 66.35 Favored Glycine 0 C--N 1.349 1.278 0 CA-C-N 115.635 -0.712 . . . . 0.0 113.595 -176.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.6 m -68.5 126.68 30.42 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.444 0.698 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.497 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 21.7 tptm -68.85 113.2 6.06 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 123.714 0.634 . . . . 0.0 109.896 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' A' ' 71' ' ' PHE . 23.5 mt -88.13 111.4 21.54 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 174.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.9 t -80.58 -18.44 48.28 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.987 0.915 . . . . 0.0 111.04 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.38 -39.5 2.49 Favored Glycine 0 C--N 1.347 1.159 0 C-N-CA 123.094 0.378 . . . . 0.0 113.295 177.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -81.88 1.57 34.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.261 0.624 . . . . 0.0 112.0 -173.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -80.41 148.68 30.46 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 48' ' ' PRO . 39.5 mt -101.67 153.38 37.95 Favored Pre-proline 0 C--N 1.306 -1.288 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 174.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.58 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.0 Cg_endo -66.81 -22.19 49.75 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.783 1.656 . . . . 0.0 111.354 176.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.81 98.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.669 0.787 . . . . 0.0 110.979 168.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -71.86 -45.49 61.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.925 0.89 . . . . 0.0 110.999 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.8 mt -75.8 -11.23 59.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.691 0.796 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.82 60.87 Favored Glycine 0 C--N 1.35 1.351 0 CA-C-N 116.946 -0.115 . . . . 0.0 113.238 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.424 ' HE2' HD12 ' A' ' 49' ' ' LEU . 61.2 mtt -73.0 161.85 30.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.022 0.929 . . . . 0.0 111.365 177.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -149.31 160.5 43.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.122 1.369 . . . . 0.0 107.696 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.9 t -60.07 111.74 1.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 176.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.65 -28.43 3.98 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-O 119.498 -0.612 . . . . 0.0 112.819 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.92 170.95 0.07 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 tp -132.55 109.58 9.87 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.812 -167.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.8 mt -96.41 152.79 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.235 1.014 . . . . 0.0 108.663 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -124.3 163.02 22.55 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -173.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.607 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 75.7 t -142.13 112.86 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 123.832 0.853 . . . . 0.0 109.231 -175.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.9 p-90 -103.71 143.39 32.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 172.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.275 0 CA-C-O 118.923 -0.932 . . . . 0.0 112.098 178.952 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 . . . . . 0 N--CA 1.474 0.742 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' ' 82' ' ' PRO . 71.4 mt -106.03 126.67 52.47 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.599 1.16 . . . . 0.0 109.072 -177.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -88.53 102.16 14.65 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 54.6 mt -109.04 129.4 55.46 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.851 0.861 . . . . 0.0 109.581 -171.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.657 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 58.9 mtt180 -87.64 105.86 17.63 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -99.76 114.22 37.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -137.05 145.51 44.11 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.592 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.339 0.73 0 O-C-N 123.423 0.452 . . . . 0.0 113.588 -173.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 91.3 m . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.1 tp -143.24 153.58 42.96 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.002 0.365 . . . . 0.0 110.218 169.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.657 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 12.4 pt-20 -133.78 133.97 42.34 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 164.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -142.05 153.98 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 123.61 0.764 . . . . 0.0 109.785 -174.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.6 m -93.26 107.28 19.13 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.6 tp -95.13 128.86 42.3 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.1 t -72.48 141.44 48.57 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.475 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.42 -28.53 69.86 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.18 0.592 . . . . 0.0 112.156 -171.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -91.09 -18.09 25.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.909 0.884 . . . . 0.0 111.524 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -94.05 129.11 38.58 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 123.525 0.73 . . . . 0.0 109.44 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.482 ' O ' HG22 ' A' ' 51' ' ' THR . 8.4 Cg_endo -67.12 161.98 40.37 Favored 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.583 2.188 . . . . 0.0 114.174 -175.212 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.45 -30.32 40.1 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 125.496 1.519 . . . . 0.0 112.207 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -38.39 72.84 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.482 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -69.37 -28.68 66.41 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.883 179.118 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -74.37 -39.08 62.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.143 0.977 . . . . 0.0 110.268 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -60.54 -42.37 96.4 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.992 0.917 . . . . 0.0 111.213 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 p -71.27 -37.27 71.9 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -65.23 -48.81 71.99 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.132 0.573 . . . . 0.0 110.429 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -53.15 -57.46 10.39 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.58 1.552 . . . . 0.0 112.235 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -60.04 -41.19 91.73 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.779 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.83 -40.58 95.78 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.149 0 C-N-CA 123.632 0.773 . . . . 0.0 112.589 -179.789 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -78.59 155.37 29.66 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.431 0.692 . . . . 0.0 111.691 -177.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -131.58 130.89 42.81 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.165 0.986 . . . . 0.0 109.582 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -128.53 146.66 50.77 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.288 1.035 . . . . 0.0 110.756 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.572 ' HB3' HD21 ' A' ' 76' ' ' LEU . 11.7 t80 -142.93 119.69 11.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.638 1.175 . . . . 0.0 108.565 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.0 t70 57.2 32.64 22.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.325 1.05 . . . . 0.0 111.042 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.13 -17.38 28.18 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.441 -0.799 . . . . 0.0 113.655 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 63.4 m -73.37 123.8 24.51 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 123.902 0.881 . . . . 0.0 110.572 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -70.32 114.24 8.26 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.572 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.7 mt -81.1 112.88 18.87 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 176.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.5 t -76.36 -21.77 55.68 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.55 0.74 . . . . 0.0 110.969 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.05 -31.84 6.07 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.49 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -91.75 9.73 31.35 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.09 0.956 . . . . 0.0 111.959 -172.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.433 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.0 pm0 -93.92 148.64 21.95 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 166.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 mt -94.69 155.83 38.98 Favored Pre-proline 0 C--N 1.314 -0.972 0 C-N-CA 125.213 1.405 . . . . 0.0 108.36 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.56 ' HB2' HD12 ' A' ' 26' ' ' LEU . 63.1 Cg_endo -67.18 -36.14 22.48 Favored 'Trans proline' 0 C--N 1.368 1.603 0 C-N-CA 121.575 1.516 . . . . 0.0 111.089 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -27.51 66.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.477 0.711 . . . . 0.0 111.184 174.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.05 -43.43 71.25 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.635 0.774 . . . . 0.0 110.844 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.433 HD21 ' HG3' ' A' ' 80' ' ' GLU . 83.9 mt -71.88 -21.46 61.65 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.732 0.813 . . . . 0.0 111.211 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.21 42.6 7.43 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 111.768 -0.533 . . . . 0.0 111.768 -178.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.407 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 73.9 mtp -95.55 165.11 12.5 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.92 0.888 . . . . 0.0 110.539 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.7 tp10 -147.8 162.46 39.17 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.409 0.684 . . . . 0.0 109.734 -177.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 p -59.64 119.87 8.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.718 0.807 . . . . 0.0 110.996 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.19 36.07 4.8 Favored Glycine 0 C--N 1.341 0.861 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.43 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t0 -98.38 -172.08 2.26 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.8 tp -142.43 109.91 5.71 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.7 mt -94.41 148.5 4.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 167.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -119.72 156.82 29.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.592 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 39.5 t -137.76 136.93 45.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -175.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 80.5 m95 . . . . . 0 N--CA 1.466 0.371 0 C-N-CA 123.998 0.919 . . . . 0.0 108.829 -175.403 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 . . . . . 0 C--O 1.24 0.565 0 CA-C-O 122.17 0.986 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.401 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 7.8 mp -98.79 109.15 21.95 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.131 -176.184 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -81.49 102.91 10.86 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.487 HD22 ' HB2' ' A' ' 91' ' ' ASP . 39.8 mt -108.7 135.84 49.27 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -174.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -91.84 130.02 37.69 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -121.89 117.84 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -132.1 139.44 48.48 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -172.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.463 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.34 0.779 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.2 tp -131.88 154.32 49.32 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.008 0.923 . . . . 0.0 108.634 176.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -132.49 134.11 44.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 162.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.68 149.76 33.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 124.194 0.998 . . . . 0.0 109.637 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.5 m -91.78 108.34 19.85 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.1 tp -96.32 131.13 43.16 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.04 0.936 . . . . 0.0 109.611 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.3 m -78.81 138.11 38.03 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.579 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.7 ptm180 -63.21 -23.83 67.6 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -175.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.08 -18.71 31.65 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.87 0.468 . . . . 0.0 110.533 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -92.28 134.19 28.74 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.168 0.987 . . . . 0.0 109.764 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.463 ' O ' HG22 ' A' ' 51' ' ' THR . 1.2 Cg_endo -70.43 164.92 33.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.558 2.172 . . . . 0.0 113.06 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -58.58 -24.63 61.26 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 111.921 178.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -34.61 71.56 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.453 0.701 . . . . 0.0 111.981 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.463 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.4 t -74.47 -31.85 62.38 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-O 120.812 0.339 . . . . 0.0 110.548 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -67.26 -42.11 84.45 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.547 1.139 . . . . 0.0 110.181 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 61.8 mtt -57.65 -47.24 82.8 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.12 0.968 . . . . 0.0 110.476 172.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 m -65.01 -30.47 71.46 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.679 1.237 . . . . 0.0 110.062 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -70.66 -56.6 6.08 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.79 -60.99 2.67 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.684 1.194 . . . . 0.0 112.521 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.3 pt-20 -60.71 -36.81 79.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -74.35 -34.76 63.48 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.115 0 C-N-CA 123.528 0.731 . . . . 0.0 111.011 -176.363 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.427 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.3 m -82.1 148.58 28.47 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.409 0.683 . . . . 0.0 109.665 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.463 ' HB3' HD23 ' A' ' 76' ' ' LEU . 45.1 m-85 -122.82 128.85 50.96 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -129.83 127.54 40.48 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.142 0.496 . . . . 0.0 111.714 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -122.45 106.95 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 107.86 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.2 t70 49.32 47.92 21.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.583 1.153 . . . . 0.0 111.485 -174.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 82.37 -22.34 6.37 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 114.778 -1.101 . . . . 0.0 114.212 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 m -71.21 111.92 6.93 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.324 0.65 . . . . 0.0 110.097 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -68.87 114.13 6.92 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.463 HD23 ' HB3' ' A' ' 69' ' ' PHE . 1.1 mm? -75.27 108.22 7.89 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 176.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.5 m -72.52 -29.18 63.37 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.13 0.972 . . . . 0.0 111.839 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.91 -58.13 0.58 Allowed Glycine 0 C--N 1.345 1.068 0 CA-C-N 116.687 -0.233 . . . . 0.0 113.116 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -88.74 10.58 20.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.737 0.815 . . . . 0.0 112.894 -166.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.572 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -86.35 149.1 25.27 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 170.403 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.5 mt -98.43 151.47 37.49 Favored Pre-proline 0 C--N 1.314 -0.976 0 C-N-CA 125.13 1.372 . . . . 0.0 108.975 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.579 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 40.0 Cg_endo -64.71 -36.1 43.0 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 121.829 1.686 . . . . 0.0 111.498 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.19 81.93 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.427 0.691 . . . . 0.0 111.151 173.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.49 -34.24 76.73 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.877 0.871 . . . . 0.0 111.322 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 80' ' ' GLU . 56.6 mt -80.77 -23.4 39.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.726 0.811 . . . . 0.0 111.79 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.45 22.85 25.63 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.7 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.447 ' HE3' HD13 ' A' ' 85' ' ' LEU . 52.7 mtt -74.28 168.95 18.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.169 0.988 . . . . 0.0 111.093 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HG2' ' H ' ' A' ' 89' ' ' SER . 34.6 tt0 -154.57 174.04 15.49 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -179.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 28.5 p -62.61 13.97 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.66 63.68 0.3 Allowed Glycine 0 C--N 1.347 1.145 0 CA-C-N 118.61 0.641 . . . . 0.0 111.614 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.487 ' HB2' HD22 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -110.58 -171.73 1.89 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.601 0.76 . . . . 0.0 110.318 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.0 tp -139.46 144.63 38.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.414 0.686 . . . . 0.0 109.435 -173.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.1 mt -134.09 136.23 53.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -125.12 100.97 6.8 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -170.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.463 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 34.0 t -71.66 128.54 34.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.788 174.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.7 m95 . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 169.544 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.547 0 CA-C-O 121.726 0.774 . . . . 0.0 112.641 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 mt -109.57 145.6 36.09 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 125.959 1.704 . . . . 0.0 108.742 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -83.01 98.42 9.25 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 175.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.433 HD13 HD11 ' A' ' 93' ' ' ILE . 77.0 mt -107.75 121.89 45.63 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.449 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 82.6 mtt85 -88.87 133.75 34.18 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -125.75 129.69 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -133.38 144.36 49.53 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.036 0.534 . . . . 0.0 110.08 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.612 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.345 1.052 0 O-C-N 123.654 0.596 . . . . 0.0 112.685 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -140.0 131.26 26.62 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.543 1.137 . . . . 0.0 108.042 -178.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.449 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.8 pt-20 -119.01 125.15 48.7 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.63 153.87 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.56 -171.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 m -91.42 108.68 20.06 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.451 HD21 HD22 ' A' ' 49' ' ' LEU . 23.1 tp -107.1 124.75 50.13 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 122.872 0.469 . . . . 0.0 109.746 175.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.602 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 43.1 m -72.52 134.99 45.54 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.641 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.0 ptm180 -73.55 -11.32 60.4 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -171.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -92.45 -17.58 24.37 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.865 0.866 . . . . 0.0 110.325 171.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -94.18 143.88 27.12 Favored Pre-proline 0 C--N 1.354 0.761 0 C-N-CA 124.013 0.925 . . . . 0.0 109.701 -178.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.478 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -72.81 160.57 45.86 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.706 2.271 . . . . 0.0 112.928 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.514 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.1 mm? -56.64 -23.94 44.84 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.399 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -37.55 73.77 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -71.0 -27.88 64.02 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.008 0.433 . . . . 0.0 110.911 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -74.0 -41.18 62.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.945 0.898 . . . . 0.0 110.286 172.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -55.35 -44.28 75.81 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.057 0.943 . . . . 0.0 110.781 176.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -72.26 -35.97 68.92 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.443 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -70.22 -48.11 58.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.263 0.625 . . . . 0.0 110.537 -175.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.3 -58.85 6.03 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.349 1.06 . . . . 0.0 111.621 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -58.59 -28.71 65.84 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.913 0.758 . . . . 0.0 112.409 -177.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.56 -40.65 63.78 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -172.954 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.44 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 120.801 0.334 . . . . 0.0 110.374 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.44 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 16.4 m -84.47 161.12 20.4 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.514 0.726 . . . . 0.0 110.623 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.428 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 32.0 m-85 -128.13 127.54 43.21 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.012 0.925 . . . . 0.0 109.156 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -123.08 137.13 55.01 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.77 0.828 . . . . 0.0 110.764 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.535 ' HB3' HD21 ' A' ' 76' ' ' LEU . 28.2 t80 -116.79 110.52 18.51 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.731 1.212 . . . . 0.0 108.318 174.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.1 t70 52.5 39.06 27.16 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-O 121.815 0.817 . . . . 0.0 111.019 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 71.52 22.52 78.62 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 114.91 -1.041 . . . . 0.0 114.656 -177.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.3 m -102.98 120.44 40.64 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.085 0.954 . . . . 0.0 109.128 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.0 114.99 6.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.91 0.484 . . . . 0.0 110.229 177.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.535 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.2 mt -84.6 120.89 26.88 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 27.4 m -77.13 -35.47 56.19 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.777 0.831 . . . . 0.0 112.509 -175.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.73 7.02 13.85 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 123.291 0.472 . . . . 0.0 113.49 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -127.59 10.89 6.71 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 124.036 0.934 . . . . 0.0 110.763 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.435 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.2 pm0 -105.08 147.84 27.45 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 174.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.99 154.17 37.45 Favored Pre-proline 0 C--N 1.311 -1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 108.579 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.641 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 44.7 Cg_endo -65.43 -29.35 53.69 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.749 1.632 . . . . 0.0 111.187 177.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.17 93.68 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.202 0.601 . . . . 0.0 110.596 172.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.03 -38.23 82.28 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.895 0.878 . . . . 0.0 111.909 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.435 HD21 ' HG3' ' A' ' 80' ' ' GLU . 70.2 mt -77.14 -24.77 51.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.649 0.779 . . . . 0.0 111.437 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.34 24.86 20.6 Favored Glycine 0 C--N 1.348 1.202 0 C-N-CA 122.036 -0.126 . . . . 0.0 113.035 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.514 ' HE1' HD11 ' A' ' 49' ' ' LEU . 63.1 mtt -74.76 170.63 15.48 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.304 1.041 . . . . 0.0 110.798 171.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -155.61 174.7 14.91 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 15.04 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -172.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.66 55.59 0.42 Allowed Glycine 0 C--N 1.342 0.903 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -106.97 -173.2 2.24 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.7 tp -140.02 134.74 31.84 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 121.72 0.771 . . . . 0.0 110.064 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.433 HD11 HD13 ' A' ' 28' ' ' LEU . 48.9 mt -127.94 151.95 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.558 1.543 . . . . 0.0 108.549 -178.546 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -116.78 165.04 13.76 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.504 1.121 . . . . 0.0 108.538 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.612 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 15.8 t -140.9 112.56 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.314 1.046 . . . . 0.0 108.805 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 m95 . . . . . 0 CA--C 1.537 0.46 0 C-N-CA 124.495 1.118 . . . . 0.0 108.947 -176.974 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 5.0 pp0? . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 111.464 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt -113.29 150.16 32.89 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.787 1.635 . . . . 0.0 108.722 177.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -105.17 108.09 19.42 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 174.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.547 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.4 mm? -109.47 141.86 41.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -176.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -97.72 123.77 41.78 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.792 0.837 . . . . 0.0 109.42 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -110.17 116.6 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -177.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -132.06 139.06 48.41 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.744 0.418 . . . . 0.0 110.069 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.559 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.348 1.242 0 O-C-N 123.512 0.508 . . . . 0.0 113.892 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -140.33 126.14 19.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.84 127.09 51.59 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.543 0.687 . . . . 0.0 109.184 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -133.88 151.11 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.061 0.944 . . . . 0.0 111.474 -168.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 67.8 m -93.39 106.92 18.83 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.015 176.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 28' ' ' LEU . 28.9 tp -107.34 131.94 53.68 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.427 1.091 . . . . 0.0 109.309 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.518 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 35.1 m -77.8 144.64 36.94 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.655 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 11.9 ptm85 -71.05 -9.32 57.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.575 0.35 . . . . 0.0 111.934 -175.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -94.86 -30.84 13.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.415 1.086 . . . . 0.0 109.849 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 m -82.11 139.28 45.72 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.969 0.907 . . . . 0.0 109.962 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.547 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 16.4 Cg_exo -62.21 153.79 67.41 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.962 2.441 . . . . 0.0 113.6 177.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.7 mm? -53.59 -29.5 37.86 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.596 170.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.547 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -58.22 -36.96 73.93 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.08 0.552 . . . . 0.0 112.428 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.84 -33.23 75.36 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 120.976 0.417 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -73.29 -42.61 62.21 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.929 1.292 . . . . 0.0 110.792 173.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.436 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 65.9 mtt -57.06 -46.04 82.76 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.444 1.098 . . . . 0.0 110.503 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 p -69.67 -33.78 73.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.272 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.46 -52.19 59.26 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.625 0.77 . . . . 0.0 110.538 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.431 ' CZ ' HG21 ' A' ' 95' ' ' VAL . 52.5 t80 -52.92 -60.2 3.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 111.831 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.9 pt-20 -57.87 -34.19 69.5 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 124.283 0.99 . . . . 0.0 111.986 -177.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.81 -47.4 85.29 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 173.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.281 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -173.54 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.459 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 CA-C-O 121.007 0.432 . . . . 0.0 111.434 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.9 m -99.64 152.99 19.44 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.702 0.801 . . . . 0.0 110.169 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -115.59 127.25 55.09 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.751 0.82 . . . . 0.0 109.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -122.79 140.96 52.35 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.931 0.892 . . . . 0.0 110.005 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.508 ' HB3' HD21 ' A' ' 76' ' ' LEU . 67.2 t80 -129.74 114.17 15.64 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.941 0.896 . . . . 0.0 108.661 174.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 56.61 34.29 24.2 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.382 1.073 . . . . 0.0 110.459 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 79.09 -2.65 68.97 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.397 -0.819 . . . . 0.0 114.243 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 97.1 m -81.49 126.87 32.19 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 117.663 0.731 . . . . 0.0 110.233 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -71.27 116.02 11.11 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 123.735 0.647 . . . . 0.0 109.65 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.508 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.6 mt -87.51 130.32 34.76 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -92.45 -25.0 18.65 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.659 0.784 . . . . 0.0 111.489 -177.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.93 -41.56 1.77 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 123.167 0.413 . . . . 0.0 113.092 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -76.71 -18.75 58.32 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.985 0.914 . . . . 0.0 112.591 -170.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.53 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.8 pm0 -71.99 149.1 45.29 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.6 mt -103.95 152.02 38.99 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.655 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 43.3 Cg_endo -64.03 -21.94 68.12 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.06 1.84 . . . . 0.0 111.708 -178.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.56 -44.35 89.66 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.054 0.941 . . . . 0.0 111.588 171.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -74.72 -39.71 61.74 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.614 0.766 . . . . 0.0 111.535 -176.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.53 HD21 ' HG3' ' A' ' 80' ' ' GLU . 95.0 mt -69.81 -23.27 63.3 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.07 0.548 . . . . 0.0 111.476 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.91 55.8 3.24 Favored Glycine 0 C--N 1.344 0.977 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 -174.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.444 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 61.0 mtp -107.74 159.62 16.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.075 0.95 . . . . 0.0 109.33 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -148.59 165.94 29.76 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.7 t -59.92 108.65 0.79 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 131.52 -31.95 3.02 Favored Glycine 0 C--N 1.354 1.534 0 CA-C-O 119.363 -0.687 . . . . 0.0 113.669 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.409 ' HB2' HD12 ' A' ' 28' ' ' LEU . 1.2 m-20 -54.15 167.24 0.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -177.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.7 tp -131.61 110.48 10.97 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 121.468 0.652 . . . . 0.0 109.538 -162.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.42 HD11 ' HE1' ' A' ' 87' ' ' MET . 38.3 mt -90.65 148.75 4.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.354 173.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -114.92 156.91 24.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -171.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.559 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 19.0 t -135.04 109.23 11.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 m0 . . . . . 0 CA--C 1.542 0.642 0 CA-C-N 114.398 -1.273 . . . . 0.0 108.043 -176.65 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.3 mt -97.1 123.54 40.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.449 1.5 . . . . 0.0 107.734 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -85.73 103.26 14.36 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -178.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 44.2 mt -111.25 132.87 54.01 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -175.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 mtt85 -99.48 126.86 45.49 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.95 133.03 52.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.704 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -139.9 153.43 46.97 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.884 0.873 . . . . 0.0 108.936 174.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.546 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.34 0.764 0 O-C-N 123.526 0.516 . . . . 0.0 112.635 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.5 m . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.691 0.281 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 tp -137.71 134.88 35.89 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -109.77 125.36 52.62 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -134.26 146.68 30.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.794 0.838 . . . . 0.0 110.605 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.7 p -95.55 107.68 19.87 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 175.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HB2' HD12 ' A' ' 52' ' ' LEU . 26.5 tp -88.49 131.14 35.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.547 -0.752 . . . . 0.0 108.992 175.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -73.82 139.88 45.41 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -61.91 -27.94 69.18 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.471 0.708 . . . . 0.0 112.477 -171.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -86.85 -27.76 23.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.101 0.96 . . . . 0.0 111.277 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -84.9 133.78 42.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.484 0.714 . . . . 0.0 110.842 -168.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.546 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 6.1 Cg_exo -60.09 157.05 36.22 Favored 'Trans proline' 0 C--N 1.378 2.113 0 C-N-CA 122.74 2.293 . . . . 0.0 113.085 177.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.489 HD11 ' HE1' ' A' ' 87' ' ' MET . 4.0 mm? -55.02 -26.98 40.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.581 1.152 . . . . 0.0 112.236 176.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.0 pttt -59.49 -33.3 71.16 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 48' ' ' PRO . 3.0 t -68.76 -32.48 72.25 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.343 0.592 . . . . 0.0 110.21 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' ' 43' ' ' LEU . 7.0 tt -74.15 -38.69 63.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.925 1.29 . . . . 0.0 110.376 173.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.9 mtt -59.04 -41.29 87.48 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.014 0.926 . . . . 0.0 110.592 176.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 24.1 m -64.44 -41.85 96.33 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 124.634 1.209 . . . . 0.0 109.789 176.033 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.42 -50.1 74.2 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.074 0.55 . . . . 0.0 110.495 -176.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -55.42 -58.01 9.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.958 0.903 . . . . 0.0 112.178 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.98 -39.1 93.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.982 -174.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 54' ' ' SER . 30.6 mm-40 -65.76 -46.33 79.19 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.102 0 C-N-CA 124.302 1.041 . . . . 0.0 113.566 -171.167 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.49 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 17.5 m -85.68 150.69 24.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.484 0.714 . . . . 0.0 110.347 -176.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -119.89 130.11 54.69 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.711 0.804 . . . . 0.0 109.88 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.451 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 17.6 m-85 -124.63 155.59 38.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.009 0.924 . . . . 0.0 110.335 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.516 ' HB3' HD21 ' A' ' 76' ' ' LEU . 56.9 t80 -140.25 112.32 7.65 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.37 1.068 . . . . 0.0 108.956 172.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 57.3 32.12 21.23 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.355 1.062 . . . . 0.0 110.995 -174.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.22 -0.45 89.71 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.645 -1.161 . . . . 0.0 114.28 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 86.3 m -83.54 122.12 28.14 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.346 0.658 . . . . 0.0 110.084 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -67.42 114.32 6.01 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.516 HD21 ' HB3' ' A' ' 71' ' ' PHE . 30.6 mt -86.42 118.93 26.17 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -78.77 -30.56 45.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.72 0.808 . . . . 0.0 112.473 -176.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.6 -47.28 1.03 Allowed Glycine 0 CA--C 1.524 0.604 0 CA-C-N 116.302 -0.408 . . . . 0.0 112.827 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -77.09 -19.74 56.64 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.439 0.696 . . . . 0.0 112.532 -169.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.469 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -69.58 149.03 48.61 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.792 0.806 . . . . 0.0 109.459 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 65.3 mt -101.96 157.4 33.77 Favored Pre-proline 0 C--N 1.309 -1.194 0 C-N-CA 125.17 1.388 . . . . 0.0 108.626 -174.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -65.24 -35.02 42.96 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 121.827 1.685 . . . . 0.0 111.515 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.31 -36.39 79.99 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.716 0.806 . . . . 0.0 111.163 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.66 -46.55 75.35 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.995 0.918 . . . . 0.0 111.473 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.469 HD21 ' HG3' ' A' ' 80' ' ' GLU . 55.6 mt -75.34 -17.1 60.33 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.22 22.73 53.87 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.132 -0.486 . . . . 0.0 113.111 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.489 ' HE1' HD11 ' A' ' 49' ' ' LEU . 48.5 mtt -64.51 152.16 42.52 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.339 1.056 . . . . 0.0 112.165 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -146.91 157.23 43.58 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 -175.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 54.7 p -56.6 117.42 3.86 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.194 0.598 . . . . 0.0 111.173 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.09 -8.65 29.2 Favored Glycine 0 C--N 1.34 0.758 0 CA-C-O 119.603 -0.554 . . . . 0.0 113.501 178.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -60.06 160.33 8.21 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 117.446 0.623 . . . . 0.0 111.868 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.2 tp -124.77 108.79 12.34 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -163.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.6 mt -88.63 150.03 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 39.8 mt-10 -112.26 155.32 24.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.502 1.121 . . . . 0.0 108.216 -171.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.546 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 41.7 t -136.02 107.45 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.763 0.825 . . . . 0.0 108.836 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 9.7 m0 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.461 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 8.6 mp0 . . . . . 0 CA--C 1.533 0.313 0 CA-C-O 121.213 0.53 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 69.9 mt -97.0 125.85 41.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.28 1.032 . . . . 0.0 108.256 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -77.26 99.0 5.33 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.6 mt -112.39 133.72 54.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.481 0.712 . . . . 0.0 109.598 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -96.5 136.39 37.07 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.437 HG13 ' HB ' ' A' ' 93' ' ' ILE . 1.9 t -125.01 134.05 67.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -132.6 146.96 52.3 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 118.221 0.464 . . . . 0.0 110.496 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.593 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.345 1.035 0 O-C-N 124.023 0.827 . . . . 0.0 112.26 171.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.9 m . . . . . 0 CA--C 1.54 0.591 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -140.76 132.57 27.46 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -120.88 129.48 53.52 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -174.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.4 p -132.14 149.53 32.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.841 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.2 p -94.98 105.78 17.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.0 tp -108.09 107.55 18.25 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.697 177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 26.9 m -32.92 120.49 0.35 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 113.093 158.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.647 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.7 ptm180 -64.03 -13.61 48.22 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -172.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 44.5 p-10 -98.68 -14.22 19.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.163 0.985 . . . . 0.0 111.092 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m -92.82 141.05 23.85 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.038 0.935 . . . . 0.0 110.124 -175.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.555 ' O ' HG22 ' A' ' 51' ' ' THR . 14.6 Cg_exo -61.12 149.33 89.69 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.313 2.675 . . . . 0.0 113.201 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.68 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.9 mm? -53.58 -29.86 39.37 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.036 -0.983 . . . . 0.0 112.336 172.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -54.89 -37.78 66.75 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.502 0.721 . . . . 0.0 112.307 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.555 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.4 t -69.42 -36.83 77.09 Favored 'General case' 0 CA--C 1.554 1.133 0 O-C-N 123.118 0.262 . . . . 0.0 110.58 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.01 -45.18 82.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.293 1.037 . . . . 0.0 110.531 175.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.495 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -54.94 -47.35 74.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.129 176.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 t -66.81 -33.79 76.4 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.463 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -67.29 -49.86 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.423 0.689 . . . . 0.0 110.159 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.449 ' CZ ' HG21 ' A' ' 95' ' ' VAL . 46.7 t80 -54.98 -60.77 2.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.167 0.987 . . . . 0.0 111.449 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.4 pt-20 -62.7 -39.38 93.81 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.549 -173.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.78 -37.75 85.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 175.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -179.827 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.452 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.971 0.415 . . . . 0.0 110.758 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.427 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 50.0 m -89.46 162.62 15.64 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.105 -177.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.47 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 45.2 m-85 -132.27 128.12 37.13 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.489 1.116 . . . . 0.0 109.249 -174.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.523 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 31.6 m-85 -125.15 122.66 37.74 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.54 0.736 . . . . 0.0 110.636 -177.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.569 ' HB3' HD21 ' A' ' 76' ' ' LEU . 27.5 t80 -98.73 106.89 19.21 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 52.01 46.11 27.15 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.259 1.023 . . . . 0.0 111.618 -171.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 76.5 1.03 69.28 Favored Glycine 0 C--N 1.347 1.175 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.907 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 54.5 m -86.64 113.02 22.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.499 0.72 . . . . 0.0 109.303 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -59.02 115.4 3.12 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.818 0.698 . . . . 0.0 109.512 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 71' ' ' PHE . 56.6 mt -88.5 127.65 35.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.131 0.972 . . . . 0.0 108.863 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.4 t -81.44 -25.55 36.05 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.697 0.799 . . . . 0.0 111.422 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.74 -47.86 1.0 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 123.78 0.705 . . . . 0.0 112.436 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -93.97 11.28 30.19 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.665 0.786 . . . . 0.0 112.365 -168.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.558 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -85.88 150.17 24.71 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 165.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.1 mt -102.26 160.37 26.57 Favored Pre-proline 0 C--N 1.309 -1.184 0 C-N-CA 124.806 1.242 . . . . 0.0 107.922 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.647 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 36.7 Cg_endo -67.22 -20.08 49.79 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.423 1.415 . . . . 0.0 111.839 171.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.88 92.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.4 0.68 . . . . 0.0 110.564 168.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -75.2 -45.46 40.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.038 0.935 . . . . 0.0 110.723 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.558 HD21 ' HG3' ' A' ' 80' ' ' GLU . 96.0 mt -68.66 -23.97 64.48 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.029 0.932 . . . . 0.0 112.783 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 71.53 64.51 2.71 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.68 ' HE1' HD11 ' A' ' 49' ' ' LEU . 30.7 ttp -128.39 153.78 46.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.35 1.06 . . . . 0.0 108.721 -173.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -149.49 167.18 26.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.598 0.759 . . . . 0.0 109.1 -170.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 m -55.71 117.85 4.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.463 0.705 . . . . 0.0 111.323 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 120.94 -21.79 8.24 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-O 119.816 -0.435 . . . . 0.0 113.245 177.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.32 169.29 0.89 Allowed 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.61 110.51 9.95 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.917 -166.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.437 ' HB ' HG13 ' A' ' 30' ' ' VAL . 62.1 mt -95.46 150.29 4.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.415 175.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 34.9 mt-10 -109.96 165.06 12.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.038 0.935 . . . . 0.0 108.7 -171.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.593 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 46.0 t -139.89 109.49 3.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 123.995 0.918 . . . . 0.0 108.912 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 74.2 m95 . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.574 1.149 . . . . 0.0 108.69 -178.074 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.448 ' OE1' ' HB3' ' A' ' 42' ' ' SER . 3.9 pp0? . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 122.065 0.936 . . . . 0.0 112.892 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.96 134.02 38.08 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.799 -160.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.62 103.37 15.76 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 45.2 mt -109.33 130.6 55.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.004 0.522 . . . . 0.0 109.935 -174.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -92.94 128.56 38.85 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.86 121.31 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -173.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -127.62 137.44 52.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.773 0.429 . . . . 0.0 109.887 -171.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.609 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.343 0.942 0 O-C-N 123.745 0.653 . . . . 0.0 112.46 176.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.1 m . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.68 122.83 20.4 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -115.46 122.72 46.63 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.025 0.917 . . . . 0.0 109.355 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.82 147.44 29.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.793 0 C-N-CA 125.045 1.338 . . . . 0.0 109.484 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.448 ' HB3' ' OE1' ' A' ' 25' ' ' GLN . 6.0 m -90.86 107.15 19.0 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 27.3 tp -104.71 131.61 51.95 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.749 0.82 . . . . 0.0 109.026 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.3 m -75.88 137.15 40.23 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.713 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 9.1 ptm180 -72.21 -6.79 45.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.742 0.306 . . . . 0.0 111.746 -175.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -92.4 -37.7 12.42 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.646 1.178 . . . . 0.0 109.887 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 m -78.01 132.55 67.06 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.599 0.76 . . . . 0.0 110.682 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.437 ' O ' HG22 ' A' ' 51' ' ' THR . 10.7 Cg_endo -64.54 162.07 32.6 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.545 2.163 . . . . 0.0 113.974 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.5 mm? -53.92 -28.03 34.32 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.433 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.83 -36.22 58.41 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -177.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 48' ' ' PRO . 10.9 t -73.26 -33.76 65.45 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 120.892 0.377 . . . . 0.0 111.129 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.72 -42.7 85.92 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.258 1.023 . . . . 0.0 110.322 172.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.41 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -58.63 -49.36 77.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.558 1.143 . . . . 0.0 110.636 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.8 p -67.15 -32.84 74.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 124.813 1.321 . . . . 0.0 109.778 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -67.43 -53.5 28.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 122.845 0.458 . . . . 0.0 110.065 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -55.27 -60.16 3.79 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.613 1.165 . . . . 0.0 111.389 -178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 53' ' ' MET . 12.3 pt-20 -56.91 -49.87 74.28 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.015 0.822 . . . . 0.0 110.901 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.26 -27.1 66.04 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.237 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 120.962 0.411 . . . . 0.0 109.998 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 41.3 m -87.82 130.81 34.75 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.495 -173.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -101.64 133.05 46.94 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.121 0.969 . . . . 0.0 110.035 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.488 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 98.3 m-85 -128.73 132.39 47.97 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.306 0.642 . . . . 0.0 111.175 177.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.473 ' HB3' HD21 ' A' ' 76' ' ' LEU . 15.7 t80 -120.63 108.52 14.12 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.6 t70 59.5 26.22 15.15 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-O 122.045 0.926 . . . . 0.0 110.456 -172.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.75 -2.9 87.33 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.517 -0.765 . . . . 0.0 114.272 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.44 ' O ' ' HA ' ' A' ' 70' ' ' PHE . 90.9 m -73.51 125.92 29.04 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 117.581 0.69 . . . . 0.0 110.197 175.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -68.66 114.03 6.67 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 123.62 0.575 . . . . 0.0 109.64 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.473 HD21 ' HB3' ' A' ' 71' ' ' PHE . 12.2 mt -93.95 124.59 38.05 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 175.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.2 m -111.56 -14.19 13.71 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.31 -63.17 0.54 Allowed Glycine 0 C--N 1.345 1.065 0 N-CA-C 113.599 0.2 . . . . 0.0 113.599 176.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -77.8 -5.14 49.79 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -167.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.4 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.6 pm0 -81.43 147.63 29.67 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 17.6 mt -99.6 153.16 37.91 Favored Pre-proline 0 C--N 1.312 -1.056 0 C-N-CA 125.343 1.457 . . . . 0.0 108.128 -176.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.713 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 50.0 Cg_endo -66.29 -36.23 28.74 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 121.768 1.645 . . . . 0.0 111.317 177.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.14 75.2 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.083 0.553 . . . . 0.0 110.966 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -65.94 -43.7 87.26 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.778 . . . . 0.0 110.624 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.4 HD21 ' HG3' ' A' ' 80' ' ' GLU . 50.6 mt -74.85 -24.83 58.65 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.63 0.772 . . . . 0.0 111.999 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 91.47 55.21 1.83 Allowed Glycine 0 C--N 1.343 0.919 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 63.4 mtt -104.34 161.87 13.7 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.986 0.914 . . . . 0.0 110.653 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.5 tp10 -148.9 160.42 43.27 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.928 0.891 . . . . 0.0 108.689 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 t -62.66 118.07 7.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.347 0.659 . . . . 0.0 110.72 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.34 41.19 3.04 Favored Glycine 0 C--N 1.34 0.771 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -173.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.5 t0 -103.9 -175.75 2.89 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.338 0.655 . . . . 0.0 109.444 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 30.9 tp -138.66 134.79 34.14 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.472 0.653 . . . . 0.0 109.447 -174.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 54.1 mt -126.54 150.39 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.923 1.289 . . . . 0.0 108.194 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.488 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 28.5 mt-10 -117.88 156.4 28.49 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 -171.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.609 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 10.2 t -140.14 139.41 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.567 0.747 . . . . 0.0 110.265 -174.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.1 m95 . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 124.812 1.245 . . . . 0.0 109.653 -175.528 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 . . . . . 0 C--O 1.238 0.488 0 CA-C-O 121.561 0.696 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 82' ' ' PRO . 44.6 mt -99.01 123.36 43.25 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.306 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -87.28 101.87 13.95 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.632 HD13 ' SD ' ' A' ' 87' ' ' MET . 28.2 mt -113.55 154.7 26.68 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.498 0.719 . . . . 0.0 111.203 -168.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.6 mtm105 -112.19 136.28 51.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.188 0.595 . . . . 0.0 110.955 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -120.29 126.04 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.216 1.407 . . . . 0.0 108.899 173.585 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -129.12 129.16 44.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.622 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.344 0.991 0 O-C-N 123.729 0.643 . . . . 0.0 113.63 -172.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.1 m . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.464 ' HB3' HG23 ' A' ' 30' ' ' VAL . 1.5 tm? -128.57 128.13 43.67 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -121.16 121.31 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.765 0.793 . . . . 0.0 109.542 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -128.15 144.83 36.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 124.817 1.247 . . . . 0.0 110.823 -171.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p -93.39 112.17 24.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.814 0.845 . . . . 0.0 109.489 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.445 ' HB3' HD12 ' A' ' 28' ' ' LEU . 36.8 tp -110.09 133.9 52.73 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.924 0.889 . . . . 0.0 109.41 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 67.3 m -77.18 147.08 36.66 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.656 0.382 . . . . 0.0 109.992 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.496 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 8.9 ptm180 -64.62 -25.9 68.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.663 0.785 . . . . 0.0 111.853 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -99.69 -16.05 18.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.258 1.023 . . . . 0.0 111.096 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.2 m -88.42 135.99 32.08 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.701 0.8 . . . . 0.0 109.438 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.524 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 2.8 Cg_endo -65.9 155.03 71.47 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 122.697 2.265 . . . . 0.0 113.283 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.04 -29.9 32.53 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 125.137 1.375 . . . . 0.0 112.255 176.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.524 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.2 pttt -55.96 -35.47 66.74 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.0 t -70.3 -32.85 70.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.0 tt -70.85 -37.6 73.12 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.599 1.16 . . . . 0.0 110.235 173.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.2 mtt -61.99 -42.09 98.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.01 0.924 . . . . 0.0 110.397 176.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.5 m -66.92 -38.58 86.47 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 124.534 1.146 . . . . 0.0 110.227 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.76 -45.6 70.98 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 122.989 0.516 . . . . 0.0 110.311 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.83 -57.96 9.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.219 1.008 . . . . 0.0 111.8 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.1 -42.51 98.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 123.946 0.779 . . . . 0.0 110.512 -174.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.58 -29.48 70.08 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 177.963 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.294 0.092 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.0 m -98.16 168.09 10.47 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.253 0.621 . . . . 0.0 111.156 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -130.99 132.12 44.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.159 1.383 . . . . 0.0 109.007 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -127.73 112.4 14.76 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.753 0.821 . . . . 0.0 110.603 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.531 ' HB3' HD21 ' A' ' 76' ' ' LEU . 10.8 t80 -102.23 111.72 24.11 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.677 1.191 . . . . 0.0 107.819 174.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.4 t70 52.47 36.16 19.52 Favored 'General case' 0 CA--C 1.564 1.495 0 CA-C-O 121.977 0.894 . . . . 0.0 110.836 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 85.75 -16.12 43.21 Favored Glycine 0 N--CA 1.478 1.466 0 CA-C-N 115.062 -0.972 . . . . 0.0 114.745 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.5 m -70.51 121.0 16.99 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.287 0.635 . . . . 0.0 110.789 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -71.23 119.71 15.75 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.531 HD21 ' HB3' ' A' ' 71' ' ' PHE . 45.0 mt -91.37 126.82 36.58 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 124.289 1.036 . . . . 0.0 109.403 -177.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.7 m -90.35 -22.97 21.25 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.892 0.877 . . . . 0.0 112.38 -176.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.21 -49.72 0.92 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 120.103 -0.276 . . . . 0.0 113.604 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.4 mtm180 -82.54 1.29 38.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.703 0.801 . . . . 0.0 112.866 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.422 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -85.26 148.12 26.22 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.4 156.8 34.82 Favored Pre-proline 0 C--N 1.313 -1.0 0 C-N-CA 125.045 1.338 . . . . 0.0 108.097 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 73.7 Cg_endo -69.32 -25.06 31.01 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 121.531 1.487 . . . . 0.0 111.126 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.48 83.97 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.324 0.649 . . . . 0.0 110.56 171.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -67.11 -40.5 86.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.422 ' HB3' ' CE2' ' A' ' 71' ' ' PHE . 88.5 mt -73.55 -23.61 60.0 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.198 0.999 . . . . 0.0 111.902 176.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.78 23.68 52.11 Favored Glycine 0 C--N 1.349 1.288 0 O-C-N 123.236 0.335 . . . . 0.0 112.858 -176.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.632 ' SD ' HD13 ' A' ' 28' ' ' LEU . 32.8 ttm -73.85 160.66 31.11 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.388 1.475 . . . . 0.0 110.848 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -140.04 157.19 46.04 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.094 0.957 . . . . 0.0 109.548 -176.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.5 m -56.45 119.49 6.13 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.358 0.663 . . . . 0.0 111.119 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.46 -15.37 32.47 Favored Glycine 0 N--CA 1.475 1.262 0 CA-C-O 119.727 -0.485 . . . . 0.0 113.91 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.64 175.85 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.54 1.136 . . . . 0.0 112.561 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.4 tp -130.79 107.66 9.3 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -172.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.1 mt -89.75 149.85 3.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 168.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -115.79 163.45 15.82 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.622 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 98.8 t -135.76 119.61 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.3 m95 . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 124.362 1.065 . . . . 0.0 109.333 -176.965 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 C--O 1.236 0.372 0 CA-C-O 121.654 0.74 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.9 mt -92.71 128.39 38.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.26 -163.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -83.85 99.82 10.57 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.479 HD13 ' SD ' ' A' ' 87' ' ' MET . 64.9 mt -110.89 130.77 55.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.868 0.867 . . . . 0.0 109.63 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 -99.15 112.11 24.33 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.018 0.527 . . . . 0.0 109.855 -176.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -100.48 119.65 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.914 0.886 . . . . 0.0 109.435 176.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -123.27 134.69 54.07 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -174.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.44 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.352 1.42 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 173.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 40.8 m . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -129.44 121.06 26.54 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -113.24 125.3 54.16 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.286 0.565 . . . . 0.0 109.72 -176.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -132.34 148.39 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.736 1.214 . . . . 0.0 110.599 -174.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.4 p -102.29 105.24 15.84 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.464 ' HB3' HD12 ' A' ' 28' ' ' LEU . 34.2 tp -91.53 135.84 33.56 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.573 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.4 m -74.19 136.69 42.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.468 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.7 ptm180 -71.51 -15.82 62.32 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -168.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.408 ' O ' HD22 ' A' ' 81' ' ' LEU . 28.8 t70 -92.67 -36.73 12.79 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.988 0.915 . . . . 0.0 110.336 172.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -66.71 143.0 97.88 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 123.545 0.738 . . . . 0.0 111.249 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.457 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -71.62 162.74 41.2 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.616 2.211 . . . . 0.0 113.1 176.873 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -56.06 -26.12 47.98 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.731 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.457 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 62.2 pttt -58.32 -37.53 75.27 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.44 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -70.56 -30.77 67.58 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 118.439 0.563 . . . . 0.0 110.82 178.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.99 -40.74 78.58 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.176 0.991 . . . . 0.0 110.428 172.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.41 -45.13 89.02 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.283 1.033 . . . . 0.0 110.046 175.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -66.28 -35.95 81.72 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 124.993 1.433 . . . . 0.0 110.703 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -68.88 -47.43 65.88 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.097 0.559 . . . . 0.0 110.258 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.36 -59.05 5.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.473 1.109 . . . . 0.0 111.819 177.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 53' ' ' MET . 10.5 pt-20 -62.54 -46.6 87.64 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.349 1.03 . . . . 0.0 111.401 -174.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -65.54 -34.53 78.47 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.237 0 C-N-CA 123.491 0.716 . . . . 0.0 112.301 178.121 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.789 0 CA-C-O 121.03 0.443 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.5 m -104.71 166.36 10.44 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.031 0.932 . . . . 0.0 110.451 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.427 ' HB3' HD12 ' A' ' 76' ' ' LEU . 65.2 m-85 -136.08 129.65 32.2 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.883 1.273 . . . . 0.0 108.722 -179.083 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.73 133.93 50.77 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.584 0.753 . . . . 0.0 111.023 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.466 ' HB3' HD21 ' A' ' 76' ' ' LEU . 54.2 t80 -129.13 116.61 19.49 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.533 1.133 . . . . 0.0 108.292 171.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.5 t70 59.05 30.47 20.28 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.492 1.117 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 87.68 -19.78 31.25 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 113.37 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.8 m -65.29 120.14 12.21 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.621 0.768 . . . . 0.0 110.494 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -68.88 113.52 6.38 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 71' ' ' PHE . 31.7 mt -82.62 119.44 24.28 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -85.94 -31.02 22.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.366 1.066 . . . . 0.0 112.315 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.7 10.49 23.04 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.803 -172.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -123.54 10.46 9.12 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.538 1.135 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -112.45 148.08 35.15 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.408 HD22 ' O ' ' A' ' 46' ' ' ASP . 14.7 mt -102.21 156.65 34.98 Favored Pre-proline 0 C--N 1.313 -0.991 0 C-N-CA 125.37 1.468 . . . . 0.0 107.767 177.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.5 Cg_endo -67.57 -21.43 46.03 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.407 1.405 . . . . 0.0 110.894 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.2 76.25 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.017 0.927 . . . . 0.0 110.719 170.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.08 -42.35 89.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.016 0.926 . . . . 0.0 111.431 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.8 mt -74.18 -24.47 59.38 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 76.37 68.7 1.49 Allowed Glycine 0 C--N 1.351 1.374 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -173.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.479 ' SD ' HD13 ' A' ' 28' ' ' LEU . 43.8 ttm -118.65 160.19 22.26 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.47 1.108 . . . . 0.0 109.8 -172.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -124.03 166.14 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.275 0.63 . . . . 0.0 109.986 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 t -76.63 15.22 0.66 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.172 0.989 . . . . 0.0 113.174 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -151.94 55.98 0.45 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -103.71 -175.05 2.69 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.033 -173.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.4 tp -143.84 107.38 4.61 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.5 mt -94.22 150.09 4.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.903 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -105.6 158.25 16.82 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.44 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.2 t -136.87 124.46 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 86.4 m95 . . . . . 0 N--CA 1.47 0.533 0 C-N-CA 123.618 0.767 . . . . 0.0 109.695 -176.55 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 . . . . . 0 CA--C 1.545 0.75 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.6 mt -107.32 134.84 49.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.918 1.287 . . . . 0.0 108.626 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -83.06 101.36 11.08 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 43' ' ' LEU . 90.3 mt -110.51 124.21 51.38 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.956 0.502 . . . . 0.0 111.225 -170.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -87.68 138.12 31.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.188 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.57 124.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 125.238 1.415 . . . . 0.0 108.103 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -122.97 129.05 51.05 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -175.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.668 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.877 0 N-CA-C 114.739 0.656 . . . . 0.0 114.739 -176.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 39.8 m . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -128.01 136.86 51.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -125.23 128.27 48.04 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.055 0.843 . . . . 0.0 110.272 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -133.96 144.25 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.451 1.1 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.2 m -94.14 107.23 19.17 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 28' ' ' LEU . 43.1 tp -93.48 134.97 35.18 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.009 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.3 m -77.68 141.2 39.52 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.457 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.1 ptm180 -63.4 -26.05 68.57 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.15 -15.98 24.15 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.784 0.834 . . . . 0.0 110.621 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.0 m -88.74 132.84 37.28 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.489 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -69.0 163.61 37.0 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.484 2.122 . . . . 0.0 113.359 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.43 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.1 mm? -57.26 -26.37 60.69 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.882 177.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.432 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 59.5 pttt -58.62 -36.89 74.78 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.3 t -72.56 -30.42 64.4 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-O 120.924 0.392 . . . . 0.0 110.661 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -71.7 -40.32 69.59 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.262 1.025 . . . . 0.0 110.304 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.486 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 63.4 mtt -56.37 -43.88 79.63 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.234 1.013 . . . . 0.0 110.462 173.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.0 t -64.1 -41.61 97.21 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 124.955 1.409 . . . . 0.0 109.837 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -66.91 -46.01 76.16 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.221 0.608 . . . . 0.0 110.962 -174.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.12 -60.85 2.91 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.699 0.8 . . . . 0.0 111.692 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.2 pt-20 -59.55 -40.6 87.83 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.91 0.757 . . . . 0.0 111.786 -176.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -64.97 -40.26 94.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.34 0 C-N-CA 123.674 0.789 . . . . 0.0 112.388 -179.114 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.413 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 121.135 0.493 . . . . 0.0 111.144 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.453 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 56.4 m -104.49 169.09 8.67 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.138 0.975 . . . . 0.0 109.885 176.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 18.4 m-85 -130.73 132.19 45.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.266 1.027 . . . . 0.0 109.0 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -127.76 121.87 31.35 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.852 0.861 . . . . 0.0 111.023 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.544 ' HB3' HD21 ' A' ' 76' ' ' LEU . 42.7 t80 -102.43 109.79 21.55 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 52.92 40.9 31.75 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.385 1.074 . . . . 0.0 111.087 -171.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 73.94 4.23 66.53 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 114.838 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 94.4 m -81.24 120.88 25.46 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.77 0.785 . . . . 0.0 109.185 173.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.453 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 3.1 tmtp? -69.42 113.12 6.44 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.544 HD21 ' HB3' ' A' ' 71' ' ' PHE . 33.5 mt -83.64 116.66 22.73 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.8 m -71.66 -27.31 62.98 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.844 0.858 . . . . 0.0 111.4 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 127.97 -44.38 1.24 Allowed Glycine 0 C--N 1.346 1.103 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.376 -177.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -80.47 -1.22 40.75 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -171.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -76.25 148.31 37.7 Favored 'General case' 0 C--N 1.347 0.467 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -102.87 149.86 37.22 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.998 1.319 . . . . 0.0 107.779 174.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 53.5 Cg_endo -66.5 -25.78 47.77 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 121.575 1.517 . . . . 0.0 111.298 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.21 96.99 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.664 0.786 . . . . 0.0 111.133 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.05 -43.48 74.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.761 0.825 . . . . 0.0 111.221 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 76.7 mt -72.17 -19.82 61.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.716 0.806 . . . . 0.0 111.757 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.94 51.24 5.93 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.521 ' SD ' HD13 ' A' ' 28' ' ' LEU . 41.7 ttm -106.36 156.55 18.4 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.831 1.252 . . . . 0.0 109.137 -174.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.9 tt0 -139.47 160.06 40.71 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.004 0.521 . . . . 0.0 110.89 -170.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.7 m -61.85 117.78 6.33 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.232 0.613 . . . . 0.0 110.333 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.15 48.77 4.47 Favored Glycine 0 C--N 1.338 0.676 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.6 t0 -102.87 -160.89 0.81 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.8 tp -142.75 109.79 5.57 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.624 0.726 . . . . 0.0 109.042 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.505 HD11 HD13 ' A' ' 28' ' ' LEU . 45.2 mt -101.0 148.35 7.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 167.448 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -115.56 162.02 17.8 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.668 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 24.6 t -138.41 103.92 2.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.1 m95 . . . . . 0 N--CA 1.471 0.578 0 C-N-CA 123.238 0.615 . . . . 0.0 110.206 -174.865 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -117.3 151.84 36.12 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.09 1.356 . . . . 0.0 108.729 -174.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -99.19 103.96 15.88 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.531 HD12 ' HB3' ' A' ' 91' ' ' ASP . 2.2 mm? -100.56 127.91 46.78 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.511 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 93.1 mtt180 -92.5 105.14 17.37 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.164 0.586 . . . . 0.0 110.25 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -99.37 118.24 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.155 -172.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HG2' HG23 ' A' ' 38' ' ' THR . 94.7 mt-30 -125.6 128.26 47.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.013 0.525 . . . . 0.0 110.58 -170.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.686 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.346 1.103 0 O-C-N 123.58 0.55 . . . . 0.0 113.625 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.407 HG23 ' HG2' ' A' ' 31' ' ' GLN . 86.9 m . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.1 tp -130.64 152.34 50.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.511 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.7 pt-20 -133.04 132.29 41.65 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 164.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -134.25 148.57 29.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 123.779 0.832 . . . . 0.0 109.662 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 m -92.08 109.4 20.76 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.275 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HB3' HD23 ' A' ' 28' ' ' LEU . 56.7 tp -105.75 133.08 51.06 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.925 177.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -77.44 146.64 36.4 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 15.0 ptm180 -66.57 -20.76 66.09 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.324 0.65 . . . . 0.0 112.161 -174.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.75 -18.51 22.84 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.399 1.08 . . . . 0.0 110.899 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.0 m -93.5 126.1 51.43 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 123.712 0.805 . . . . 0.0 109.542 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.48 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 9.9 Cg_endo -65.98 164.41 27.45 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.138 1.892 . . . . 0.0 113.826 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.472 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -59.94 -25.92 65.55 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.106 -177.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 65.0 pttt -57.34 -38.03 73.47 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.3 t -70.45 -31.31 68.42 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 117.819 0.281 . . . . 0.0 110.53 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -69.47 -42.12 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.231 1.012 . . . . 0.0 110.276 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -56.96 -44.89 83.05 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.424 1.089 . . . . 0.0 110.505 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.8 m -67.56 -39.14 84.93 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 113.89 -1.505 . . . . 0.0 110.134 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -65.17 -45.87 83.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.968 0.507 . . . . 0.0 110.164 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -55.9 -60.36 3.58 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.78 1.232 . . . . 0.0 111.722 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.77 -38.09 86.72 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.584 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -65.9 -35.32 80.31 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 121.868 -0.52 . . . . 0.0 111.89 175.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.238 0 C-N-CA 123.461 0.704 . . . . 0.0 112.798 -177.833 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.409 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.446 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.0 m -87.11 159.89 18.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.377 0.671 . . . . 0.0 111.241 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.83 129.14 40.06 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -128.87 143.1 50.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.03 0.932 . . . . 0.0 111.69 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.576 ' HB3' HD21 ' A' ' 76' ' ' LEU . 16.2 t80 -133.67 104.32 6.29 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.914 1.685 . . . . 0.0 107.845 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t70 55.18 30.45 14.54 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 122.519 1.152 . . . . 0.0 111.841 -174.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 88.3 -3.66 85.42 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 114.94 -1.027 . . . . 0.0 113.679 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.0 m -75.54 113.94 13.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.442 0.697 . . . . 0.0 109.596 174.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -66.88 113.59 5.05 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 173.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 71' ' ' PHE . 38.8 mt -78.94 112.19 15.88 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.252 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.0 m -78.95 -26.65 43.56 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.94 0.896 . . . . 0.0 112.672 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.04 -45.73 1.1 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.618 -178.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.16 4.83 44.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 111.431 -164.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.2 pm0 -91.75 147.99 22.58 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.5 mt -98.2 156.21 36.09 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 125.71 1.604 . . . . 0.0 109.108 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.565 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 54.6 Cg_endo -66.76 -23.95 47.79 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 121.546 1.498 . . . . 0.0 111.485 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 -37.52 68.81 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.677 0.791 . . . . 0.0 111.188 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -62.63 -42.47 99.61 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.805 0.842 . . . . 0.0 110.48 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.505 HD21 ' HG3' ' A' ' 80' ' ' GLU . 76.8 mt -79.25 -24.0 43.3 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.81 0.844 . . . . 0.0 111.348 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 73.64 64.8 2.38 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 -175.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 70.2 mtp -106.87 170.85 7.7 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.9 0.88 . . . . 0.0 110.391 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.454 ' H ' ' HB2' ' A' ' 91' ' ' ASP . 39.1 tt0 -126.83 169.51 13.15 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.958 0.903 . . . . 0.0 109.954 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -75.1 11.78 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.787 0.835 . . . . 0.0 112.503 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -148.58 46.77 0.67 Allowed Glycine 0 C--N 1.34 0.797 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.531 ' HB3' HD12 ' A' ' 28' ' ' LEU . 7.2 t70 -93.04 176.64 6.34 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 28.6 tp -131.4 118.88 20.87 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -172.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 44.6 mt -106.63 147.24 12.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 170.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -124.54 155.67 38.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -175.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.686 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 11.6 t -135.12 126.76 46.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 123.343 0.657 . . . . 0.0 109.242 -171.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.8 m95 . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 124.246 1.018 . . . . 0.0 109.395 -174.399 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 11.2 pt20 . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 121.146 0.498 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' A' ' 82' ' ' PRO . 57.5 mt -110.59 135.11 51.73 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.778 1.231 . . . . 0.0 108.577 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -90.8 103.84 16.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 35.3 mt -109.65 132.97 53.65 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.185 -0.322 . . . . 0.0 110.329 -171.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -95.2 140.68 29.78 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -129.7 132.37 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -173.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -135.84 141.94 44.74 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.065 0.393 . . . . 0.0 110.866 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.687 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.347 1.141 0 O-C-N 123.683 0.615 . . . . 0.0 113.306 177.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 120.694 0.283 . . . . 0.0 110.77 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.57 121.16 18.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.33 1.052 . . . . 0.0 108.204 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -105.11 116.23 31.59 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -123.6 144.95 31.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 123.992 0.917 . . . . 0.0 110.251 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.8 p -91.19 110.02 21.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 44.6 tp -109.59 134.16 52.26 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.735 0.814 . . . . 0.0 108.813 177.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 57.4 m -73.57 142.77 46.62 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 176.11 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.542 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 35.5 ptt180 -62.49 -27.64 69.28 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.2 0.6 . . . . 0.0 112.13 -173.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -95.92 -9.94 30.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.729 0.811 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 44' ' ' SER . 66.4 m -90.13 139.67 27.24 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 123.681 0.793 . . . . 0.0 109.443 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.59 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 7.2 Cg_exo -65.88 157.45 59.06 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.872 2.381 . . . . 0.0 113.093 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.6 mm? -58.11 -27.8 64.06 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.519 173.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.59 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 61.2 pttt -58.09 -38.07 75.7 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.604 0.638 . . . . 0.0 112.608 -177.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.473 HG22 ' O ' ' A' ' 48' ' ' PRO . 13.2 t -72.49 -29.39 63.6 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 120.817 0.341 . . . . 0.0 110.454 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 tt -69.72 -42.52 73.9 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.885 0.874 . . . . 0.0 110.099 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.5 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -56.9 -46.86 81.64 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.344 1.058 . . . . 0.0 110.51 177.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.7 t -64.36 -35.57 81.32 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.404 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -68.7 -46.32 69.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.381 0.672 . . . . 0.0 110.216 -178.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -57.39 -60.15 4.08 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.359 1.064 . . . . 0.0 111.823 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.15 -32.81 73.46 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.84 0.712 . . . . 0.0 111.787 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -73.44 -38.54 65.48 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 C-N-CA 123.724 0.81 . . . . 0.0 112.669 -175.335 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.422 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.767 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.483 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 21.3 m -86.57 162.32 18.07 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.406 0.683 . . . . 0.0 111.243 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -131.22 126.76 36.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.394 1.078 . . . . 0.0 109.152 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.431 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 9.6 m-85 -123.44 151.29 42.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.618 0.767 . . . . 0.0 110.762 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.577 ' HB3' HD21 ' A' ' 76' ' ' LEU . 22.2 t80 -137.25 114.11 10.52 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 172.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.8 25.68 15.21 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.794 0.838 . . . . 0.0 110.824 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 78.03 4.46 86.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.561 -174.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.0 m -82.82 120.2 25.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.785 0.834 . . . . 0.0 109.066 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tmtp? -68.12 115.29 7.44 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.577 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.4 mt -81.97 112.06 18.71 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.0 t -71.87 -34.22 69.03 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.767 0.827 . . . . 0.0 111.979 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.86 -9.43 11.43 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 116.009 -0.541 . . . . 0.0 113.356 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -109.82 10.97 24.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.514 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.4 pm0 -101.74 147.92 25.89 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -98.86 156.26 35.74 Favored Pre-proline 0 C--N 1.312 -1.023 0 C-N-CA 125.183 1.393 . . . . 0.0 108.683 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.542 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 49.4 Cg_endo -65.38 -33.02 49.15 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.799 1.666 . . . . 0.0 111.072 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.16 79.64 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.848 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.49 -42.93 77.95 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.935 0.894 . . . . 0.0 111.683 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.514 HD21 ' HG3' ' A' ' 80' ' ' GLU . 85.0 mt -70.95 -22.98 62.15 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.447 0.699 . . . . 0.0 111.293 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 99.06 17.67 26.79 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.724 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.3 mtt -71.06 166.9 20.41 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.777 0.831 . . . . 0.0 111.627 177.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -166.19 2.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.197 0.999 . . . . 0.0 109.67 175.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.7 m -78.64 12.83 1.87 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -165.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -162.09 63.23 0.27 Allowed Glycine 0 C--N 1.352 1.426 0 CA-C-N 118.245 0.475 . . . . 0.0 112.22 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.44 -168.65 1.72 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.693 0.397 . . . . 0.0 110.038 -170.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.3 tp -139.83 127.5 21.78 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.827 0.851 . . . . 0.0 109.23 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.4 mt -121.2 152.63 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.935 1.294 . . . . 0.0 108.448 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.431 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 30.8 mt-10 -114.04 160.73 18.56 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.793 1.237 . . . . 0.0 107.899 -173.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.687 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 9.4 t -137.26 107.88 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.85 0.86 . . . . 0.0 109.034 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.2 m0 . . . . . 0 CA--C 1.541 0.622 0 C-N-CA 124.218 1.007 . . . . 0.0 108.656 -176.936 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.516 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 4.3 pp0? . . . . . 0 C--O 1.24 0.563 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.405 HD22 ' HB2' ' A' ' 82' ' ' PRO . 6.6 mp -102.73 125.21 49.38 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.149 1.38 . . . . 0.0 109.437 -166.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -80.07 100.53 8.24 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 176.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.7 mt -114.13 128.86 56.57 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.767 0.427 . . . . 0.0 110.049 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -95.33 132.05 40.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -123.17 129.42 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -174.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -129.55 130.59 45.95 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.613 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.346 1.11 0 O-C-N 123.368 0.417 . . . . 0.0 113.335 -177.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m . . . . . 0 C--O 1.236 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -128.0 113.53 15.95 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 -170.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -106.74 121.98 45.45 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -172.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -132.01 147.11 32.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.854 0.862 . . . . 0.0 110.832 -171.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.8 m -90.9 111.62 23.13 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.248 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.492 HD21 HD22 ' A' ' 49' ' ' LEU . 29.2 tp -114.62 121.24 42.81 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.254 0.621 . . . . 0.0 109.523 175.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 21.3 m -75.16 149.13 39.09 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.559 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 30.6 ptt180 -69.94 -13.47 62.26 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -99.42 -19.62 16.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.498 0.719 . . . . 0.0 109.665 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.44 ' HB3' HG21 ' A' ' 51' ' ' THR . 58.0 m -85.54 133.4 42.15 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.197 0.999 . . . . 0.0 109.597 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.467 ' O ' HG22 ' A' ' 51' ' ' THR . 3.3 Cg_exo -71.77 159.42 50.75 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.492 HD22 HD21 ' A' ' 43' ' ' LEU . 2.7 mm? -53.85 -30.69 46.66 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.06 1.344 . . . . 0.0 111.774 177.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -39.76 58.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.007 0.923 . . . . 0.0 112.935 177.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.467 HG22 ' O ' ' A' ' 48' ' ' PRO . 2.5 t -69.72 -33.12 72.04 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 120.87 0.367 . . . . 0.0 110.888 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.85 -38.68 73.17 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.254 1.021 . . . . 0.0 110.455 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.482 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -59.01 -42.77 90.93 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.818 0.847 . . . . 0.0 110.192 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -61.62 -42.51 98.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.709 1.256 . . . . 0.0 110.827 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -68.96 -44.73 72.37 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.316 0.647 . . . . 0.0 110.922 -174.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -58.13 -54.05 51.35 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.304 1.042 . . . . 0.0 111.61 176.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.59 -41.62 96.13 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.593 0.558 . . . . 0.0 110.641 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -57.56 -44.37 85.21 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.765 0.426 . . . . 0.0 111.657 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.387 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.483 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.1 m -83.22 156.79 22.98 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.85 0.86 . . . . 0.0 111.209 -176.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 36.1 m-85 -125.51 128.95 48.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.678 1.191 . . . . 0.0 108.84 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -131.35 139.41 49.51 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.65 0.78 . . . . 0.0 111.033 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -131.59 111.72 11.97 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.429 1.492 . . . . 0.0 108.266 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 53.88 30.36 11.39 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.801 1.241 . . . . 0.0 112.044 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 92.07 -19.01 51.96 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.712 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.2 m -70.79 137.69 49.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.932 0.893 . . . . 0.0 110.665 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -89.41 117.24 28.19 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.41 109.34 13.68 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -79.24 -28.83 42.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.641 0.776 . . . . 0.0 111.457 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.65 -52.04 0.66 Allowed Glycine 0 C--N 1.348 1.201 0 C-N-CA 122.994 0.33 . . . . 0.0 113.327 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.0 mtp-105 -85.6 2.12 46.35 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.916 0.886 . . . . 0.0 113.315 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.556 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.1 pm0 -85.71 148.82 25.69 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 38.5 mt -100.4 151.35 37.53 Favored Pre-proline 0 C--N 1.316 -0.885 0 C-N-CA 124.957 1.303 . . . . 0.0 108.614 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.559 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 57.5 Cg_endo -65.51 -35.05 40.42 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 121.966 1.777 . . . . 0.0 111.232 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . . . -60.26 -33.84 72.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.971 0.909 . . . . 0.0 111.151 173.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -73.8 -44.67 55.17 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.539 0.735 . . . . 0.0 110.72 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.556 HD21 ' HG3' ' A' ' 80' ' ' GLU . 26.5 mt -66.9 -24.53 66.12 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.217 0.607 . . . . 0.0 110.817 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 88.77 51.79 2.96 Favored Glycine 0 C--N 1.345 1.079 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -175.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.2 mtp -112.82 165.33 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.408 1.083 . . . . 0.0 109.946 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.403 ' HG2' ' N ' ' A' ' 89' ' ' SER . 31.1 tt0 -153.6 166.45 32.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.142 0.977 . . . . 0.0 108.839 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.403 ' N ' ' HG2' ' A' ' 88' ' ' GLU . 33.3 m -54.59 111.8 0.88 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.568 0.747 . . . . 0.0 110.052 173.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.98 -28.79 3.3 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.045 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.48 168.21 1.66 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.8 tp -130.26 109.04 10.47 Favored 'General case' 0 C--N 1.349 0.555 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -168.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.7 mt -92.06 152.2 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 171.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -124.06 165.16 17.97 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 -178.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.613 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 14.8 t -137.06 133.61 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 93.8 m95 . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 124.319 1.048 . . . . 0.0 108.745 -170.901 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.577 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 3.2 pp0? . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.408 0.623 . . . . 0.0 109.803 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -116.06 150.41 37.34 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.03 1.332 . . . . 0.0 107.504 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -99.82 103.32 14.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.568 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.8 mm? -101.16 126.97 47.91 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.376 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -91.48 105.28 17.65 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.387 0.675 . . . . 0.0 109.768 -176.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.33 123.82 52.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.041 0.937 . . . . 0.0 108.695 -173.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -130.69 138.19 49.91 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.816 0.446 . . . . 0.0 110.491 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.645 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.347 1.154 0 O-C-N 123.684 0.615 . . . . 0.0 113.185 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.4 m . . . . . 0 C--O 1.237 0.417 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.5 tp -131.97 154.35 49.4 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 173.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.1 132.53 44.91 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 167.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -131.0 146.39 34.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 123.613 0.765 . . . . 0.0 109.521 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.3 p -90.86 105.94 18.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.568 ' HB3' HD23 ' A' ' 28' ' ' LEU . 66.6 tp -107.34 130.72 54.75 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.919 176.157 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.577 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 41.9 t -75.62 152.32 37.65 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.654 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 31.6 ptt180 -69.13 -13.38 62.39 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.479 0.712 . . . . 0.0 111.746 179.342 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -99.13 -23.67 15.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.919 0.888 . . . . 0.0 109.882 177.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 133.04 50.88 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.63 0.772 . . . . 0.0 110.305 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.48 ' O ' HG22 ' A' ' 51' ' ' THR . 6.1 Cg_exo -69.64 158.6 56.54 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.833 2.355 . . . . 0.0 113.271 178.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.3 mm? -58.35 -25.79 62.38 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.742 1.217 . . . . 0.0 112.04 177.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.51 -39.16 75.9 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.223 0.609 . . . . 0.0 112.387 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -72.38 -29.53 63.85 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 120.897 0.38 . . . . 0.0 110.778 -178.029 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -70.39 -41.45 72.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.037 0.935 . . . . 0.0 110.314 172.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 63.8 mtt -55.02 -49.72 70.85 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.994 0.918 . . . . 0.0 110.835 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 p -67.06 -38.35 85.65 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.972 1.42 . . . . 0.0 109.627 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -64.64 -48.79 73.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.024 0.53 . . . . 0.0 110.288 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -56.29 -59.08 5.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.088 0.955 . . . . 0.0 111.837 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -62.31 -31.64 72.28 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.027 0.83 . . . . 0.0 112.55 -175.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -70.72 -46.42 63.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.434 0.294 . . . . 0.0 111.789 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.196 0 C-N-CA 123.55 0.74 . . . . 0.0 112.451 -173.602 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.458 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.058 0.456 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 160.27 14.76 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.289 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -124.68 131.79 53.44 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.011 0.924 . . . . 0.0 109.37 -177.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -134.06 116.92 16.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.388 1.075 . . . . 0.0 110.534 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.428 ' HB3' HD11 ' A' ' 76' ' ' LEU . 2.3 t80 -97.41 109.76 22.45 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.6 t70 51.8 40.57 28.01 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.052 0.93 . . . . 0.0 111.02 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 72.71 6.27 66.42 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 114.982 -1.008 . . . . 0.0 114.575 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -87.84 116.99 26.38 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.97 0.908 . . . . 0.0 109.57 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -67.16 113.84 5.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.425 0.453 . . . . 0.0 110.232 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.428 HD11 ' HB3' ' A' ' 71' ' ' PHE . 1.1 mm? -80.65 123.69 28.37 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.7 m -75.09 -30.12 60.82 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.768 0.827 . . . . 0.0 110.716 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.91 -38.32 2.27 Favored Glycine 0 C--N 1.345 1.034 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.219 -175.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -87.55 2.56 50.44 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -170.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -89.54 147.71 23.8 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 172.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.2 mt -97.21 158.08 33.84 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 125.119 1.368 . . . . 0.0 108.261 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.654 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 62.0 Cg_endo -66.29 -27.56 47.95 Favored 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 110.781 176.018 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.69 -37.12 81.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.594 0.757 . . . . 0.0 110.707 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -68.65 -41.33 79.5 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.789 0.835 . . . . 0.0 110.647 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.536 HD21 ' HG3' ' A' ' 80' ' ' GLU . 84.5 mt -75.54 -24.12 56.7 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.074 0.95 . . . . 0.0 112.17 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.99 58.56 3.18 Favored Glycine 0 C--N 1.346 1.091 0 O-C-N 123.371 0.419 . . . . 0.0 112.22 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.8 mtp -102.83 171.0 7.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.115 0.966 . . . . 0.0 110.079 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.4 tt0 -137.23 157.57 46.35 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.068 0.547 . . . . 0.0 110.876 -178.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.3 p -59.28 111.1 1.23 Allowed 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 168.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 94.8 42.23 3.9 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.889 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.536 ' HB3' HD12 ' A' ' 28' ' ' LEU . 2.4 t70 -97.53 -171.57 2.22 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 177.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 35.7 tp -137.03 135.48 37.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.261 0.625 . . . . 0.0 109.5 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.4 mt -127.34 148.92 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.66 154.36 39.48 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -173.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.645 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.8 t -133.7 121.93 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.3 m95 . . . . . 0 C--O 1.236 0.368 0 C-N-CA 124.407 1.083 . . . . 0.0 109.566 -172.923 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.433 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 4.3 pp0? . . . . . 0 N--CA 1.468 0.426 0 CA-C-O 121.812 0.815 . . . . 0.0 111.563 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -116.77 151.01 37.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.698 1.599 . . . . 0.0 109.323 -177.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -103.06 109.78 21.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 171.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.513 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.1 mm? -112.24 139.63 47.62 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.3 mtp85 -92.76 112.83 24.93 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.493 0.717 . . . . 0.0 110.546 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.28 113.5 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.499 1.12 . . . . 0.0 108.665 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -126.29 133.59 51.37 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -172.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.578 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.873 0 O-C-N 123.718 0.636 . . . . 0.0 112.556 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.3 m . . . . . 0 C--O 1.237 0.439 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -139.85 142.38 36.59 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -133.71 136.61 44.77 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -140.2 151.71 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 123.919 0.887 . . . . 0.0 109.989 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -92.13 108.67 20.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.424 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.513 ' HB3' HD23 ' A' ' 28' ' ' LEU . 31.2 tp -105.21 131.47 52.64 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.531 1.132 . . . . 0.0 109.178 175.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 44.7 m -76.84 151.65 35.79 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.514 0.509 . . . . 0.0 109.654 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.595 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 12.8 ptm180 -67.53 -18.69 65.12 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.257 0.551 . . . . 0.0 110.949 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -92.92 -30.93 15.14 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.138 1.375 . . . . 0.0 109.77 -175.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.414 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 50.6 m -88.34 140.63 30.34 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.21 1.004 . . . . 0.0 110.35 -176.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.506 ' O ' HG22 ' A' ' 51' ' ' THR . 6.8 Cg_exo -67.78 157.66 60.76 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.221 2.614 . . . . 0.0 113.408 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -51.79 -32.35 30.88 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.061 1.344 . . . . 0.0 112.068 173.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.466 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -58.88 -35.88 73.72 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.638 0.775 . . . . 0.0 112.593 -177.351 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.506 HG22 ' O ' ' A' ' 48' ' ' PRO . 4.3 t -67.7 -33.69 75.39 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.93 -40.78 68.52 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.532 1.133 . . . . 0.0 110.607 175.193 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.9 mtt -58.83 -46.33 87.92 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.072 0.949 . . . . 0.0 110.865 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 p -68.18 -28.06 66.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.48 1.112 . . . . 0.0 110.799 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -71.31 -47.7 55.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.323 0.649 . . . . 0.0 110.322 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.26 -58.83 5.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.38 1.072 . . . . 0.0 111.905 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 53' ' ' MET . 6.7 pt-20 -59.52 -31.04 69.02 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 124.018 0.823 . . . . 0.0 112.427 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.47 -43.06 70.56 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -174.968 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.466 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -93.3 158.69 15.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.424 0.69 . . . . 0.0 110.732 -175.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 48.1 m-85 -124.32 127.83 48.21 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.432 1.093 . . . . 0.0 109.375 -176.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.25 129.76 49.57 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.082 0.953 . . . . 0.0 110.195 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.494 ' HB3' HD21 ' A' ' 76' ' ' LEU . 51.6 t80 -108.02 109.41 20.86 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.77 27.08 16.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.557 1.143 . . . . 0.0 111.391 -172.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.55 -2.11 88.26 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.055 -0.521 . . . . 0.0 113.852 -175.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.8 m -79.01 122.56 26.34 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -67.87 117.64 10.02 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 71' ' ' PHE . 21.5 mt -92.29 120.34 32.74 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.2 t -77.47 -23.02 50.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.264 0.626 . . . . 0.0 110.965 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.99 -38.64 2.99 Favored Glycine 0 C--N 1.344 0.991 0 C-N-CA 123.043 0.354 . . . . 0.0 113.286 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.7 mtp180 -76.41 -14.98 60.04 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.558 0.743 . . . . 0.0 112.849 -171.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.24 149.02 44.94 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 173.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 48' ' ' PRO . 21.8 mt -99.13 157.21 34.46 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 125.161 1.384 . . . . 0.0 107.302 176.129 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.595 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.1 Cg_endo -65.54 -17.02 56.3 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 121.466 1.444 . . . . 0.0 111.39 178.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.78 93.38 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.747 0.819 . . . . 0.0 111.006 170.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -68.01 -45.62 73.54 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.107 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.514 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 79.5 mt -74.24 -15.0 61.01 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.616 0.766 . . . . 0.0 112.561 -176.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.67 35.73 27.86 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.153 0.283 . . . . 0.0 112.991 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.514 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 60.5 mtp -90.22 166.4 13.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.169 0.988 . . . . 0.0 110.855 -177.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -153.81 166.38 33.07 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.3 t -61.51 112.05 2.05 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.888 0.475 . . . . 0.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 130.5 -27.63 3.92 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.814 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.451 ' HB2' HD12 ' A' ' 28' ' ' LEU . 1.8 m-20 -58.08 172.72 0.4 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.2 tp -133.83 113.94 12.8 Favored 'General case' 0 C--N 1.352 0.682 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.393 -163.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.411 HD11 ' HE1' ' A' ' 87' ' ' MET . 39.4 mt -100.39 149.17 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 172.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 69' ' ' PHE . 36.5 mt-10 -112.96 158.38 20.31 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -172.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.578 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.1 t -135.15 118.73 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.1 m95 . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 125.277 1.431 . . . . 0.0 109.033 -178.965 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 121.032 0.444 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 82.8 mt -91.55 129.67 37.5 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.587 -174.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -89.17 102.73 15.38 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.636 HD23 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mm? -106.19 122.02 45.35 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -89.79 124.36 34.59 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.328 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.83 117.17 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.223 1.009 . . . . 0.0 109.54 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -127.01 130.92 50.96 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.965 0.906 . . . . 0.0 108.579 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.485 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.339 0.698 0 O-C-N 123.753 0.658 . . . . 0.0 113.596 -173.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.241 0.627 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -131.2 137.47 48.97 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -132.01 141.57 49.3 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.056 0.455 . . . . 0.0 109.878 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.33 152.6 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.119 0.968 . . . . 0.0 109.84 178.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -91.71 110.78 22.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.636 ' HB3' HD23 ' A' ' 28' ' ' LEU . 32.2 tp -102.85 136.66 42.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.465 0.706 . . . . 0.0 109.824 176.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 34.0 t -76.29 143.88 40.62 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.582 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.1 ptm180 -60.58 -29.41 69.17 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.986 0.914 . . . . 0.0 112.835 -175.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -110.57 3.06 19.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.532 0.733 . . . . 0.0 111.977 -178.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 70.1 m -93.47 134.04 27.33 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 170.385 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.567 ' O ' HG22 ' A' ' 51' ' ' THR . 2.8 Cg_exo -65.95 155.69 68.21 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.753 2.302 . . . . 0.0 112.784 -176.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -53.54 -27.53 26.54 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.982 1.313 . . . . 0.0 112.322 176.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.69 -37.98 74.39 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.759 0.824 . . . . 0.0 112.949 179.555 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.3 t -67.3 -33.31 75.02 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.348 0.594 . . . . 0.0 110.359 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.36 -41.06 66.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.961 1.304 . . . . 0.0 110.442 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.2 mtt -55.05 -44.03 74.34 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.93 0.892 . . . . 0.0 110.915 176.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -67.26 -35.38 79.39 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -71.53 -46.76 58.7 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.909 0.484 . . . . 0.0 110.777 -175.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -54.09 -57.46 11.0 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.811 0.845 . . . . 0.0 111.743 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.7 pt-20 -60.1 -31.83 70.41 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.894 0.746 . . . . 0.0 111.768 -177.037 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.51 -36.75 76.75 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 173.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -178.214 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.517 HD23 ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 121.209 0.528 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 31.8 m -113.32 156.57 23.14 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.306 1.042 . . . . 0.0 109.803 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.517 ' CE1' HD23 ' A' ' 67' ' ' LEU . 38.9 m-85 -122.61 128.2 50.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.659 0.784 . . . . 0.0 110.041 -172.1 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 60.7 m-85 -127.44 139.32 52.9 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.868 0.867 . . . . 0.0 110.783 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -116.24 107.08 14.41 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 51.19 41.42 27.73 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 122.093 0.949 . . . . 0.0 111.244 -172.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.55 -8.22 66.02 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 115.032 -0.985 . . . . 0.0 114.949 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.8 m -74.51 115.58 14.21 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.225 0.61 . . . . 0.0 109.719 178.182 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.48 114.06 4.59 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.01 109.12 16.06 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.6 m -69.48 -28.11 65.79 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.089 0.955 . . . . 0.0 111.005 -176.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.52 -49.5 0.9 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.385 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -87.42 10.83 16.22 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.628 0.771 . . . . 0.0 112.967 -170.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 mp0 -83.87 148.13 27.14 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 173.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 30.3 mt -101.26 152.05 37.86 Favored Pre-proline 0 C--N 1.309 -1.182 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 176.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.582 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 59.1 Cg_endo -64.36 -35.66 49.14 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.687 1.591 . . . . 0.0 110.989 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.52 -30.55 70.25 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.164 0.586 . . . . 0.0 110.8 175.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -71.87 -45.16 62.31 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.805 0.842 . . . . 0.0 111.592 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.425 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 54.6 mt -69.91 -24.94 63.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.49 0.716 . . . . 0.0 111.487 -176.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.0 45.92 3.48 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 -173.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.425 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 63.3 mtp -104.76 163.97 12.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.158 0.983 . . . . 0.0 108.99 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.415 ' HG2' ' H ' ' A' ' 89' ' ' SER . 38.4 tt0 -135.07 178.37 7.08 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 -176.358 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.415 ' H ' ' HG2' ' A' ' 88' ' ' GLU . 30.0 p -74.19 19.22 0.13 Allowed 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -176.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.09 61.14 0.3 Allowed Glycine 0 C--N 1.344 0.985 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 172.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.485 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -111.12 -177.49 3.22 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.568 0.747 . . . . 0.0 109.399 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 37.6 tp -137.52 114.78 10.94 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 109.913 -167.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 43.1 mt -98.11 150.91 4.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 113.956 -1.474 . . . . 0.0 108.563 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 41.9 mt-10 -106.14 152.86 22.89 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 -175.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.485 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.6 t -130.63 109.44 16.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 92.1 m95 . . . . . 0 CA--C 1.533 0.293 0 C-N-CA 124.156 0.982 . . . . 0.0 109.835 -174.617 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 40.4 mt-30 . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 82' ' ' PRO . 56.2 mt -107.84 129.27 55.08 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.187 1.395 . . . . 0.0 109.173 -177.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -84.25 103.12 13.18 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -112.27 132.49 54.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.034 0.534 . . . . 0.0 110.336 -175.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -91.2 110.59 21.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.169 0.987 . . . . 0.0 109.021 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HE2' ' A' ' 69' ' ' PHE . 2.2 t -105.78 124.72 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -177.284 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -135.5 145.14 46.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 118.099 0.409 . . . . 0.0 110.359 -173.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.557 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.348 1.225 0 O-C-N 123.374 0.421 . . . . 0.0 112.538 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 m . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 120.858 0.361 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 56' ' ' TYR . 15.2 tp -138.3 127.39 24.16 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 167.149 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -103.17 113.03 26.18 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 175.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.95 151.17 23.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 123.828 0.851 . . . . 0.0 110.435 -172.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -92.49 109.23 20.62 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 171.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.433 ' HB2' HD12 ' A' ' 52' ' ' LEU . 23.6 tp -105.82 125.53 51.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.25 0.62 . . . . 0.0 109.381 172.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 58.6 m -73.18 144.34 46.87 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.525 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 26.4 ptt180 -62.54 -26.51 68.61 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.876 0.87 . . . . 0.0 112.398 -173.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -99.56 -11.7 20.78 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.783 0.833 . . . . 0.0 111.029 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 50.4 m -92.34 136.77 25.19 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 123.743 0.817 . . . . 0.0 109.381 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.551 ' O ' HG22 ' A' ' 51' ' ' THR . 3.7 Cg_exo -71.41 161.69 44.75 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.796 2.331 . . . . 0.0 113.781 -176.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.558 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.8 mm? -53.83 -31.4 49.14 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 125.241 1.416 . . . . 0.0 112.242 175.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -32.71 72.42 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.551 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -70.18 -33.26 71.51 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 118.113 0.415 . . . . 0.0 111.036 174.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.433 HD12 ' HB2' ' A' ' 43' ' ' LEU . 6.3 tt -68.94 -39.31 79.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.1 0.96 . . . . 0.0 110.126 173.578 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.3 mtt -59.01 -42.73 90.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.327 1.051 . . . . 0.0 110.09 175.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 t -68.02 -40.28 82.97 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.259 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -66.63 -48.2 70.2 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 120.952 0.406 . . . . 0.0 110.569 -174.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.417 ' HA ' HD22 ' A' ' 39' ' ' LEU . 50.4 t80 -55.18 -53.46 55.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.005 1.322 . . . . 0.0 112.213 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.83 -46.62 84.26 Favored 'General case' 0 CA--C 1.558 1.253 0 O-C-N 124.154 0.908 . . . . 0.0 110.908 -179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.38 -45.54 84.36 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.241 0.616 . . . . 0.0 111.994 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.079 0 C-N-CA 124.074 0.95 . . . . 0.0 112.935 -178.087 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.593 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 21.1 m -76.95 144.46 38.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.407 0.283 . . . . 0.0 110.892 -174.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.451 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 49.2 m-85 -120.26 125.85 49.13 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.894 0.877 . . . . 0.0 109.892 179.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -125.13 133.08 52.97 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.266 1.026 . . . . 0.0 110.094 177.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.447 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.1 t80 -124.46 114.56 19.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.219 1.008 . . . . 0.0 108.538 174.403 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.14 27.83 15.58 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.593 1.157 . . . . 0.0 111.368 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.84 -8.17 76.98 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.314 -0.857 . . . . 0.0 113.828 -177.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 96.7 m -73.76 119.86 18.56 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.114 0.566 . . . . 0.0 110.272 176.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -68.07 113.5 5.79 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.447 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.3 mt -82.03 116.84 21.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.7 m -73.37 -31.65 64.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.656 0.782 . . . . 0.0 111.155 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.8 -48.65 0.96 Allowed Glycine 0 C--N 1.343 0.923 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.296 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.5 mtp85 -86.45 9.72 17.34 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -169.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -84.66 147.54 26.89 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 166.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.16 161.96 26.41 Favored Pre-proline 0 C--N 1.313 -0.981 0 C-N-CA 124.541 1.136 . . . . 0.0 108.566 174.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.525 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 60.8 Cg_endo -66.23 -30.29 46.07 Favored 'Trans proline' 0 C--N 1.368 1.581 0 C-N-CA 121.429 1.419 . . . . 0.0 110.812 174.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.4 80.12 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.053 0.941 . . . . 0.0 111.032 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -69.54 -48.78 59.25 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.016 0.927 . . . . 0.0 111.841 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.426 HD12 ' HE2' ' A' ' 87' ' ' MET . 87.9 mt -71.83 -20.8 61.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.433 0.693 . . . . 0.0 111.397 -177.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.92 15.66 51.29 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.455 0.472 . . . . 0.0 112.456 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.558 ' HE1' HD11 ' A' ' 49' ' ' LEU . 57.9 mtm -76.54 160.09 29.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.326 0.65 . . . . 0.0 110.869 177.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -160.82 166.64 28.24 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.712 1.205 . . . . 0.0 107.981 -170.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.1 m -61.04 106.08 0.55 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 118.029 0.377 . . . . 0.0 110.519 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 136.56 -32.73 2.43 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.032 -0.531 . . . . 0.0 113.219 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.7 170.81 0.07 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.4 tp -132.16 109.28 9.85 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -168.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 51.6 mt -95.94 147.96 5.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.567 -1.272 . . . . 0.0 107.567 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -124.06 161.76 24.89 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -172.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.557 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.7 t -140.06 128.04 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.844 0.858 . . . . 0.0 110.418 -169.174 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.593 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 55.9 m95 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.5 mp -110.23 147.95 32.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.23 1.412 . . . . 0.0 108.431 -172.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -102.14 104.73 15.35 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.547 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.9 mm? -104.65 135.85 45.28 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -175.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -90.59 128.94 36.75 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.94 123.21 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -172.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -134.01 141.06 47.09 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.016 0.371 . . . . 0.0 110.564 -173.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.666 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.894 0 O-C-N 123.871 0.732 . . . . 0.0 112.323 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.0 m . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 121.143 0.497 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.3 tp -136.3 136.29 39.63 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -119.54 122.85 42.55 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.0 p -128.76 149.45 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 123.935 0.894 . . . . 0.0 110.562 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 p -92.93 108.94 20.39 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 28' ' ' LEU . 28.1 tp -103.91 134.33 47.38 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.456 1.102 . . . . 0.0 109.494 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.9 t -79.0 145.72 33.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.627 ' HB2' ' HB2' ' A' ' 83' ' ' ALA . 33.6 ptt180 -68.41 -13.51 62.35 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.753 0.421 . . . . 0.0 112.041 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -97.65 -21.71 16.88 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.115 0.966 . . . . 0.0 109.91 177.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.6 m -88.38 134.75 33.85 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.509 ' O ' HG22 ' A' ' 51' ' ' THR . 5.4 Cg_exo -71.11 163.39 39.36 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 122.71 2.273 . . . . 0.0 112.968 178.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 53' ' ' MET . 2.6 mm? -60.65 -22.94 64.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.479 1.112 . . . . 0.0 111.655 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.43 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -56.94 -38.29 72.72 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.302 0.641 . . . . 0.0 112.166 178.52 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.6 t -71.0 -28.77 64.66 Favored 'General case' 0 C--N 1.355 0.84 0 CA-C-O 120.862 0.363 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -74.58 -41.11 61.08 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 110.359 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -55.43 -48.93 73.68 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.785 0.834 . . . . 0.0 111.051 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.7 p -70.41 -33.63 71.58 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 113.868 -1.515 . . . . 0.0 109.61 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.11 -52.7 46.25 Favored 'General case' 0 C--N 1.354 0.787 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -55.84 -60.7 3.09 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 123.829 0.852 . . . . 0.0 111.506 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.43 -38.11 79.81 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.792 0.682 . . . . 0.0 112.749 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.66 -29.07 61.11 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 123.087 0.555 . . . . 0.0 111.804 -179.439 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.471 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 110.998 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.1 m -91.58 163.51 14.1 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.99 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 35.4 m-85 -129.02 130.45 46.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.319 1.048 . . . . 0.0 108.968 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -130.44 129.02 42.46 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.726 0.81 . . . . 0.0 111.485 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -119.2 111.99 18.93 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.632 1.573 . . . . 0.0 107.673 172.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 51.56 40.69 27.61 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.065 0.936 . . . . 0.0 112.011 -177.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 81.54 -19.28 9.14 Favored Glycine 0 N--CA 1.478 1.457 0 CA-C-N 115.012 -0.994 . . . . 0.0 114.589 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.7 m -71.23 116.03 11.07 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.458 0.703 . . . . 0.0 109.919 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -70.87 113.69 8.18 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.33 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.22 116.23 13.51 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 m -74.06 -35.68 64.29 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.153 0.981 . . . . 0.0 111.886 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.15 -56.25 0.51 Allowed Glycine 0 C--N 1.347 1.165 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.925 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -89.77 10.29 24.06 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -167.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.512 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.9 OUTLIER -86.43 148.46 25.55 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 175.415 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.1 mt -101.39 149.84 36.69 Favored Pre-proline 0 C--N 1.315 -0.92 0 C-N-CA 124.993 1.317 . . . . 0.0 109.18 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 56.7 Cg_endo -66.13 -24.79 51.4 Favored 'Trans proline' 0 C--N 1.377 2.073 0 C-N-CA 122.07 1.846 . . . . 0.0 111.44 179.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.627 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . . . -60.64 -47.45 86.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.813 0.845 . . . . 0.0 110.267 170.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -71.17 -32.68 69.2 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.808 -175.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.512 HD21 ' HG3' ' A' ' 80' ' ' GLU . 72.9 mt -75.63 -23.04 56.3 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.551 0.74 . . . . 0.0 111.175 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.41 52.62 4.72 Favored Glycine 0 C--N 1.344 1.026 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 -175.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 71.5 mtp -97.58 174.87 6.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.678 0.791 . . . . 0.0 110.148 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.5 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 38.6 tt0 -133.99 155.8 49.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.241 0.616 . . . . 0.0 110.576 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 p -63.05 115.19 4.21 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 165.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.54 52.63 3.3 Favored Glycine 0 C--N 1.342 0.879 0 N-CA-C 111.613 -0.595 . . . . 0.0 111.613 -169.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t70 -110.07 -159.46 0.68 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.4 tp -142.93 143.54 32.04 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.865 0.841 . . . . 0.0 110.576 -175.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.2 mt -139.3 150.78 22.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 C-N-CA 126.472 1.909 . . . . 0.0 106.734 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -121.68 168.04 12.24 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 109.625 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.666 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 44.0 t -142.41 105.3 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 -174.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 94.6 m95 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 121.736 0.779 . . . . 0.0 109.636 -175.743 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 . . . . . 0 C--O 1.24 0.565 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 82' ' ' PRO . 77.2 mt -108.21 125.98 52.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.886 1.274 . . . . 0.0 109.53 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.53 102.92 14.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 42.4 mt -110.39 131.44 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.08 0.552 . . . . 0.0 109.75 -173.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 92' ' ' LEU . 64.4 mtt85 -94.3 109.94 21.72 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.518 0.727 . . . . 0.0 109.213 -178.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -101.13 127.63 54.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.451 ' HG2' HG23 ' A' ' 38' ' ' THR . 70.8 mt-30 -134.45 153.1 52.1 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -177.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.534 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 N--CA 1.463 0.435 0 O-C-N 123.399 0.437 . . . . 0.0 112.766 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.451 HG23 ' HG2' ' A' ' 31' ' ' GLN . 90.7 m . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 tp -142.59 144.66 32.96 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.585 1.154 . . . . 0.0 108.158 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -120.22 115.68 24.09 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.42 150.05 27.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 123.936 0.894 . . . . 0.0 110.134 -170.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.7 m -92.21 108.57 20.05 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.7 tp -105.54 123.59 48.15 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.2 m -72.87 147.71 45.11 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -177.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.34 -27.69 68.68 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.955 0.902 . . . . 0.0 112.482 -171.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -101.07 -12.05 19.15 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.549 0.739 . . . . 0.0 111.006 -178.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 67.7 m -83.82 134.8 43.66 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 123.293 0.637 . . . . 0.0 109.819 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.586 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 2.7 Cg_exo -67.78 158.01 59.19 Favored 'Trans proline' 0 C--N 1.368 1.554 0 C-N-CA 122.707 2.271 . . . . 0.0 113.122 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.65 HD11 ' HE1' ' A' ' 87' ' ' MET . 4.0 mm? -54.24 -30.78 51.43 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.782 1.233 . . . . 0.0 111.974 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.586 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.57 -34.37 69.13 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.487 HG22 ' O ' ' A' ' 48' ' ' PRO . 2.8 t -71.77 -33.01 68.27 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 120.862 0.363 . . . . 0.0 110.936 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 tt -68.43 -41.76 79.89 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.539 1.135 . . . . 0.0 110.356 173.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.464 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.5 -48.31 81.22 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.189 0.995 . . . . 0.0 109.74 176.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 t -63.1 -38.73 92.36 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 113.998 -1.455 . . . . 0.0 110.901 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -63.02 -50.1 72.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.004 0.522 . . . . 0.0 110.06 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.495 ' CE2' HG21 ' A' ' 95' ' ' VAL . 48.2 t80 -55.82 -57.03 13.74 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.558 1.143 . . . . 0.0 112.389 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -65.77 -42.5 90.77 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.374 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -63.8 -38.22 90.28 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 123.753 0.821 . . . . 0.0 113.098 -179.965 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.459 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.762 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.421 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 17.4 m -77.23 153.06 34.4 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.859 0.463 . . . . 0.0 111.089 -176.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -125.61 125.61 43.41 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.084 0.954 . . . . 0.0 109.317 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -124.86 143.67 50.71 Favored 'General case' 0 C--O 1.212 -0.881 0 C-N-CA 124.001 0.92 . . . . 0.0 109.973 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -118.91 105.48 11.53 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.6 t70 55.76 28.33 12.11 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 124.145 0.978 . . . . 0.0 111.691 -170.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.04 1.5 79.38 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.692 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.3 m -79.1 119.62 22.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.474 0.71 . . . . 0.0 109.413 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.65 114.01 8.31 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.6 mt -83.4 126.69 33.0 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -83.38 -34.44 25.57 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.507 0.723 . . . . 0.0 111.845 -175.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.99 -60.87 0.56 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.57 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 57.3 mtp85 -84.02 5.96 23.84 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -169.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.6 pm0 -76.31 147.86 37.9 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 170.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -100.1 162.7 20.15 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 124.424 1.09 . . . . 0.0 108.883 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.494 ' HB2' HD12 ' A' ' 26' ' ' LEU . 62.9 Cg_endo -66.8 -23.51 48.05 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 121.606 1.537 . . . . 0.0 111.01 174.009 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.97 -32.95 73.72 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.919 0.887 . . . . 0.0 111.244 171.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.61 -47.63 21.73 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.723 0.809 . . . . 0.0 110.922 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.492 HD21 ' HG3' ' A' ' 80' ' ' GLU . 77.3 mt -72.13 -15.29 61.98 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.32 0.648 . . . . 0.0 111.404 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.36 28.36 55.82 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.529 0.518 . . . . 0.0 112.534 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.65 ' HE1' HD11 ' A' ' 49' ' ' LEU . 66.2 mtm -84.36 168.21 15.8 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.72 0.808 . . . . 0.0 111.593 177.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -155.87 169.3 24.73 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.715 1.206 . . . . 0.0 108.367 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 m -57.39 112.25 1.35 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.26 0.624 . . . . 0.0 110.911 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 122.71 -14.21 8.6 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-O 119.624 -0.542 . . . . 0.0 113.629 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.49 170.46 1.02 Allowed 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 175.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 29' ' ' ARG . 43.9 tp -132.61 111.7 11.43 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.877 -169.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 56.8 mt -100.63 152.31 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.525 1.13 . . . . 0.0 108.182 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -115.45 163.33 15.88 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.687 1.195 . . . . 0.0 108.741 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.534 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 22.3 t -136.97 110.1 8.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 124.465 1.106 . . . . 0.0 108.994 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.8 m95 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.792 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 10.4 pt20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.424 HD12 ' HB2' ' A' ' 82' ' ' PRO . 53.5 mt -114.29 128.91 56.58 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.47 1.508 . . . . 0.0 109.448 177.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.23 105.17 17.28 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.05 135.66 52.41 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.822 0.849 . . . . 0.0 109.831 -169.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 81.6 mtt180 -95.38 111.99 23.78 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.823 0.849 . . . . 0.0 110.313 -177.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.17 129.97 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.987 0.915 . . . . 0.0 109.874 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -131.05 146.67 52.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.76 0.824 . . . . 0.0 108.923 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.63 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 N--CA 1.466 0.693 0 C-N-CA 121.603 -0.332 . . . . 0.0 113.138 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 120.768 0.318 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -137.12 151.15 48.52 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.869 1.268 . . . . 0.0 107.582 173.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.613 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.0 pt-20 -131.3 126.35 35.13 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -135.23 147.72 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.798 -172.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.8 m -92.77 110.81 22.26 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.57 0.748 . . . . 0.0 109.042 -178.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 32.7 tp -110.26 130.79 55.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.328 1.051 . . . . 0.0 109.594 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 20.8 t -75.41 145.76 41.32 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.63 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.63 -21.36 65.62 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -172.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -106.17 -7.86 17.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.905 0.882 . . . . 0.0 111.849 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.9 m -90.37 134.54 30.97 Favored Pre-proline 0 CA--C 1.543 0.689 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.532 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 8.1 Cg_exo -63.5 155.35 63.09 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.899 2.4 . . . . 0.0 113.403 -178.443 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.0 mm? -53.28 -30.36 38.2 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 124.561 1.145 . . . . 0.0 111.874 173.043 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.532 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.85 -37.05 73.17 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.077 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.507 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -68.52 -33.47 74.17 Favored 'General case' 0 CA--C 1.561 1.367 0 CA-C-O 121.053 0.454 . . . . 0.0 110.759 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 tt -70.61 -38.33 73.97 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.718 1.207 . . . . 0.0 110.177 173.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.477 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 62.2 mtt -60.5 -40.02 89.85 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.212 1.005 . . . . 0.0 111.155 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -65.49 -38.44 89.75 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.477 1.111 . . . . 0.0 110.182 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -67.33 -47.55 70.16 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.611 0.364 . . . . 0.0 110.409 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.5 -55.83 27.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.406 0.682 . . . . 0.0 111.677 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.52 -38.15 88.85 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 123.674 0.609 . . . . 0.0 112.149 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -66.81 -47.75 71.07 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.569 0.348 . . . . 0.0 111.612 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.052 0 C-N-CA 124.113 0.965 . . . . 0.0 112.185 -177.571 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.475 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.621 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.493 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 74.9 m -99.39 175.08 5.98 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.498 0.719 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -141.51 139.03 33.18 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.448 1.099 . . . . 0.0 109.553 -163.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -123.28 143.45 50.05 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.0 0.92 . . . . 0.0 110.664 174.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.528 ' HB3' HD21 ' A' ' 76' ' ' LEU . 66.4 t80 -129.6 106.12 8.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 171.061 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.12 26.94 16.8 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.445 1.098 . . . . 0.0 110.761 -170.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 90.55 -13.12 66.35 Favored Glycine 0 C--N 1.349 1.278 0 CA-C-N 115.635 -0.712 . . . . 0.0 113.595 -176.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.6 m -68.5 126.68 30.42 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.444 0.698 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.493 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 21.7 tptm -68.85 113.2 6.06 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 123.714 0.634 . . . . 0.0 109.896 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.528 HD21 ' HB3' ' A' ' 71' ' ' PHE . 23.5 mt -88.13 111.4 21.54 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 174.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.9 t -80.58 -18.44 48.28 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.987 0.915 . . . . 0.0 111.04 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.38 -39.5 2.49 Favored Glycine 0 C--N 1.347 1.159 0 C-N-CA 123.094 0.378 . . . . 0.0 113.295 177.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -81.88 1.57 34.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.261 0.624 . . . . 0.0 112.0 -173.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -80.41 148.68 30.46 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 39.5 mt -101.67 153.38 37.95 Favored Pre-proline 0 C--N 1.306 -1.288 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 174.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.63 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.0 Cg_endo -66.81 -22.19 49.75 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.783 1.656 . . . . 0.0 111.354 176.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.81 98.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.669 0.787 . . . . 0.0 110.979 168.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -71.86 -45.49 61.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.925 0.89 . . . . 0.0 110.999 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.8 mt -75.8 -11.23 59.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.691 0.796 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.82 60.87 Favored Glycine 0 C--N 1.35 1.351 0 CA-C-N 116.946 -0.115 . . . . 0.0 113.238 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' MET . . . . . 0.432 ' HE1' HD11 ' A' ' 49' ' ' LEU . 61.2 mtt -73.0 161.85 30.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.022 0.929 . . . . 0.0 111.365 177.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -149.31 160.5 43.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.122 1.369 . . . . 0.0 107.696 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.9 t -60.07 111.74 1.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 176.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.65 -28.43 3.98 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-O 119.498 -0.612 . . . . 0.0 112.819 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.92 170.95 0.07 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 tp -132.55 109.58 9.87 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.812 -167.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.8 mt -96.41 152.79 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.235 1.014 . . . . 0.0 108.663 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -124.3 163.02 22.55 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -173.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.63 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 75.7 t -142.13 112.86 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 123.832 0.853 . . . . 0.0 109.231 -175.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.9 p-90 . . . . . 0 CA--C 1.537 0.443 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 172.391 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.704 ' N ' ' HG ' ' A' ' 23' ' ' SER . 24.3 p . . . . . 0 CA--C 1.551 0.997 0 CA-C-O 119.871 -0.109 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -141.17 -45.0 0.38 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.352 175.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.8 p -108.12 79.76 1.3 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 168.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.704 ' HG ' ' N ' ' A' ' 20' ' ' THR . 6.4 m -100.76 115.22 29.79 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.742 -170.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -66.06 -52.37 49.56 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.217 0.607 . . . . 0.0 109.453 176.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -130.41 154.97 47.16 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.012 0.925 . . . . 0.0 108.69 172.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' ' 82' ' ' PRO . 71.4 mt -106.03 126.67 52.47 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.599 1.16 . . . . 0.0 109.072 -177.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -88.53 102.16 14.65 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 54.6 mt -109.04 129.4 55.46 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.851 0.861 . . . . 0.0 109.581 -171.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.657 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 58.9 mtt180 -87.64 105.86 17.63 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -99.76 114.22 37.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -137.05 145.51 44.11 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.592 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -86.55 174.53 46.72 Favored Glycine 0 C--N 1.339 0.73 0 O-C-N 123.423 0.452 . . . . 0.0 113.588 -173.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -44.64 -32.1 1.36 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.362 1.465 . . . . 0.0 112.697 166.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -91.15 135.82 33.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.222 1.009 . . . . 0.0 108.585 173.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.13 -20.28 62.34 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 117.925 0.329 . . . . 0.0 111.035 175.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -69.3 -34.55 74.87 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.641 0.777 . . . . 0.0 110.178 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -74.32 118.53 17.38 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 91.3 m -159.0 113.53 2.45 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -156.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.1 tp -143.24 153.58 42.96 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.002 0.365 . . . . 0.0 110.218 169.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.657 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 12.4 pt-20 -133.78 133.97 42.34 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 164.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -142.05 153.98 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 123.61 0.764 . . . . 0.0 109.785 -174.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.6 m -93.26 107.28 19.13 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.6 tp -95.13 128.86 42.3 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.1 t -72.48 141.44 48.57 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.475 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.42 -28.53 69.86 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.18 0.592 . . . . 0.0 112.156 -171.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -91.09 -18.09 25.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.909 0.884 . . . . 0.0 111.524 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -94.05 129.11 38.58 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 123.525 0.73 . . . . 0.0 109.44 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.482 ' O ' HG22 ' A' ' 51' ' ' THR . 8.4 Cg_endo -67.12 161.98 40.37 Favored 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.583 2.188 . . . . 0.0 114.174 -175.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.45 -30.32 40.1 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 125.496 1.519 . . . . 0.0 112.207 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -38.39 72.84 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.482 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -69.37 -28.68 66.41 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.883 179.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -74.37 -39.08 62.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.143 0.977 . . . . 0.0 110.268 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -60.54 -42.37 96.4 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.992 0.917 . . . . 0.0 111.213 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 p -71.27 -37.27 71.9 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -65.23 -48.81 71.99 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.132 0.573 . . . . 0.0 110.429 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -53.15 -57.46 10.39 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.58 1.552 . . . . 0.0 112.235 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -60.04 -41.19 91.73 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.779 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.83 -40.58 95.78 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.83 80.29 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.632 0.773 . . . . 0.0 112.589 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 69.8 mtm -107.71 27.29 9.33 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.235 0.614 . . . . 0.0 111.949 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 49.05 36.11 20.23 Favored Glycine 0 CA--C 1.541 1.66 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.97 18.62 6.44 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 124.072 0.949 . . . . 0.0 110.553 168.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.0 m -56.19 99.28 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.861 0.864 . . . . 0.0 111.256 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.73 -48.37 0.95 Allowed Glycine 0 C--N 1.345 1.057 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -84.66 77.55 10.03 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -80.14 139.47 36.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.573 -170.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -111.23 159.37 17.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.783 1.233 . . . . 0.0 109.618 -175.381 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -78.59 155.37 29.66 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.431 0.692 . . . . 0.0 111.691 -177.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -131.58 130.89 42.81 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.165 0.986 . . . . 0.0 109.582 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -128.53 146.66 50.77 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.288 1.035 . . . . 0.0 110.756 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.572 ' HB3' HD21 ' A' ' 76' ' ' LEU . 11.7 t80 -142.93 119.69 11.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.638 1.175 . . . . 0.0 108.565 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.0 t70 57.2 32.64 22.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.325 1.05 . . . . 0.0 111.042 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.13 -17.38 28.18 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.441 -0.799 . . . . 0.0 113.655 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 63.4 m -73.37 123.8 24.51 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 123.902 0.881 . . . . 0.0 110.572 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -70.32 114.24 8.26 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.572 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.7 mt -81.1 112.88 18.87 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 176.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.5 t -76.36 -21.77 55.68 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.55 0.74 . . . . 0.0 110.969 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.05 -31.84 6.07 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.49 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -91.75 9.73 31.35 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.09 0.956 . . . . 0.0 111.959 -172.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.433 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.0 pm0 -93.92 148.64 21.95 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 166.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 mt -94.69 155.83 38.98 Favored Pre-proline 0 C--N 1.314 -0.972 0 C-N-CA 125.213 1.405 . . . . 0.0 108.36 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.56 ' HB2' HD12 ' A' ' 26' ' ' LEU . 63.1 Cg_endo -67.18 -36.14 22.48 Favored 'Trans proline' 0 C--N 1.368 1.603 0 C-N-CA 121.575 1.516 . . . . 0.0 111.089 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -27.51 66.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.477 0.711 . . . . 0.0 111.184 174.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.05 -43.43 71.25 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.635 0.774 . . . . 0.0 110.844 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.433 HD21 ' HG3' ' A' ' 80' ' ' GLU . 83.9 mt -71.88 -21.46 61.65 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.732 0.813 . . . . 0.0 111.211 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.21 42.6 7.43 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 111.768 -0.533 . . . . 0.0 111.768 -178.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.407 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 73.9 mtp -95.55 165.11 12.5 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.92 0.888 . . . . 0.0 110.539 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.7 tp10 -147.8 162.46 39.17 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.409 0.684 . . . . 0.0 109.734 -177.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.651 ' HG ' ' N ' ' A' ' 20' ' ' THR . 33.7 p -59.64 119.87 8.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.718 0.807 . . . . 0.0 110.996 176.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.19 36.07 4.8 Favored Glycine 0 C--N 1.341 0.861 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.43 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t0 -98.38 -172.08 2.26 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.8 tp -142.43 109.91 5.71 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.7 mt -94.41 148.5 4.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 167.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -119.72 156.82 29.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.592 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 39.5 t -137.76 136.93 45.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -175.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -135.19 135.42 41.01 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.998 0.919 . . . . 0.0 108.829 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.206 0 CA-C-O 118.716 -1.047 . . . . 0.0 112.02 -177.753 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.62 -45.99 0.41 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.716 0.406 . . . . 0.0 111.5 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 59.2 p -110.95 78.94 1.15 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -103.51 67.35 0.91 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 155.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -83.12 -60.21 2.22 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 173.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -129.76 154.55 47.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.47 178.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.401 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 7.8 mp -98.79 109.15 21.95 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.131 -176.184 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -81.49 102.91 10.86 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.487 HD22 ' HB2' ' A' ' 91' ' ' ASP . 39.8 mt -108.7 135.84 49.27 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -174.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -91.84 130.02 37.69 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -121.89 117.84 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -132.1 139.44 48.48 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -172.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.463 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -91.29 -176.35 43.41 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -70.65 20.49 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 173.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -158.08 145.88 18.46 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.242 1.017 . . . . 0.0 108.963 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -65.78 -21.16 66.48 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.507 0.723 . . . . 0.0 111.672 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -56.27 -38.19 70.84 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.143 0.977 . . . . 0.0 110.299 172.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.515 ' HG3' ' HG2' ' A' ' 60' ' ' MET . 2.4 mp0 -97.94 81.98 2.93 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.442 172.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.4 m -125.47 120.15 30.17 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.809 -0.557 . . . . 0.0 110.404 163.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.2 tp -131.88 154.32 49.32 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.008 0.923 . . . . 0.0 108.634 176.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -132.49 134.11 44.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 162.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.68 149.76 33.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 124.194 0.998 . . . . 0.0 109.637 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.5 m -91.78 108.34 19.85 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.1 tp -96.32 131.13 43.16 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.04 0.936 . . . . 0.0 109.611 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.3 m -78.81 138.11 38.03 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.579 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.7 ptm180 -63.21 -23.83 67.6 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -175.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.08 -18.71 31.65 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.87 0.468 . . . . 0.0 110.533 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -92.28 134.19 28.74 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.168 0.987 . . . . 0.0 109.764 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.463 ' O ' HG22 ' A' ' 51' ' ' THR . 1.2 Cg_endo -70.43 164.92 33.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.558 2.172 . . . . 0.0 113.06 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -58.58 -24.63 61.26 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 111.921 178.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -34.61 71.56 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.453 0.701 . . . . 0.0 111.981 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.463 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.4 t -74.47 -31.85 62.38 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-O 120.812 0.339 . . . . 0.0 110.548 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -67.26 -42.11 84.45 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.547 1.139 . . . . 0.0 110.181 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 61.8 mtt -57.65 -47.24 82.8 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.12 0.968 . . . . 0.0 110.476 172.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 m -65.01 -30.47 71.46 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.679 1.237 . . . . 0.0 110.062 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -70.66 -56.6 6.08 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.79 -60.99 2.67 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.684 1.194 . . . . 0.0 112.521 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.3 pt-20 -60.71 -36.81 79.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -74.35 -34.76 63.48 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.69 -49.34 14.69 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.528 0.731 . . . . 0.0 111.011 -176.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.515 ' HG2' ' HG3' ' A' ' 37' ' ' GLN . 51.4 tpp -73.66 -14.5 61.17 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.045 -173.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 16.67 25.37 Favored Glycine 0 C--N 1.353 1.519 0 O-C-N 122.448 -0.158 . . . . 0.0 113.419 174.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -91.12 33.52 0.96 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.161 0.984 . . . . 0.0 110.299 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 m -74.06 103.22 4.45 Favored 'General case' 0 C--O 1.243 0.721 0 C-N-CA 123.639 0.776 . . . . 0.0 110.28 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 113.75 -3.73 24.49 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.539 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -139.53 105.05 5.09 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.914 0.886 . . . . 0.0 109.379 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.427 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.62 163.76 24.35 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.157 0.983 . . . . 0.0 109.817 -177.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.3 m -82.1 148.58 28.47 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.409 0.683 . . . . 0.0 109.665 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.463 ' HB3' HD23 ' A' ' 76' ' ' LEU . 45.1 m-85 -122.82 128.85 50.96 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -129.83 127.54 40.48 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.142 0.496 . . . . 0.0 111.714 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -122.45 106.95 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 107.86 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.2 t70 49.32 47.92 21.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.583 1.153 . . . . 0.0 111.485 -174.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 82.37 -22.34 6.37 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 114.778 -1.101 . . . . 0.0 114.212 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 m -71.21 111.92 6.93 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.324 0.65 . . . . 0.0 110.097 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -68.87 114.13 6.92 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.463 HD23 ' HB3' ' A' ' 69' ' ' PHE . 1.1 mm? -75.27 108.22 7.89 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 176.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.5 m -72.52 -29.18 63.37 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.13 0.972 . . . . 0.0 111.839 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.91 -58.13 0.58 Allowed Glycine 0 C--N 1.345 1.068 0 CA-C-N 116.687 -0.233 . . . . 0.0 113.116 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -88.74 10.58 20.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.737 0.815 . . . . 0.0 112.894 -166.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.572 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -86.35 149.1 25.27 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 170.403 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.5 mt -98.43 151.47 37.49 Favored Pre-proline 0 C--N 1.314 -0.976 0 C-N-CA 125.13 1.372 . . . . 0.0 108.975 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.579 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 40.0 Cg_endo -64.71 -36.1 43.0 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 121.829 1.686 . . . . 0.0 111.498 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.19 81.93 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.427 0.691 . . . . 0.0 111.151 173.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.49 -34.24 76.73 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.877 0.871 . . . . 0.0 111.322 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 80' ' ' GLU . 56.6 mt -80.77 -23.4 39.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.726 0.811 . . . . 0.0 111.79 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.45 22.85 25.63 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.7 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.447 ' HE3' HD13 ' A' ' 85' ' ' LEU . 52.7 mtt -74.28 168.95 18.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.169 0.988 . . . . 0.0 111.093 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HG2' ' H ' ' A' ' 89' ' ' SER . 34.6 tt0 -154.57 174.04 15.49 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -179.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 28.5 p -62.61 13.97 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.66 63.68 0.3 Allowed Glycine 0 C--N 1.347 1.145 0 CA-C-N 118.61 0.641 . . . . 0.0 111.614 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.487 ' HB2' HD22 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -110.58 -171.73 1.89 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.601 0.76 . . . . 0.0 110.318 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.0 tp -139.46 144.63 38.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.414 0.686 . . . . 0.0 109.435 -173.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.1 mt -134.09 136.23 53.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -125.12 100.97 6.8 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -170.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.463 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 34.0 t -71.66 128.54 34.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.788 174.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -101.1 94.0 5.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 169.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.79 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.062 -177.357 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.59 HG21 HE21 ' A' ' 24' ' ' GLN . 55.8 m . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.09 -27.25 13.64 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.462 0.705 . . . . 0.0 111.231 177.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.1 p -70.61 121.08 17.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.58 0.752 . . . . 0.0 109.325 176.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 m -39.78 100.57 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.424 -170.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.59 HE21 HG21 ' A' ' 20' ' ' THR . 8.5 tp-100 -81.14 -38.29 27.41 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.469 -170.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.2 OUTLIER -89.34 142.87 27.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.578 -1.192 . . . . 0.0 112.641 -165.749 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 mt -109.57 145.6 36.09 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 125.959 1.704 . . . . 0.0 108.742 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -83.01 98.42 9.25 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 175.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.433 HD13 HD11 ' A' ' 93' ' ' ILE . 77.0 mt -107.75 121.89 45.63 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.449 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 82.6 mtt85 -88.87 133.75 34.18 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -125.75 129.69 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -133.38 144.36 49.53 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.036 0.534 . . . . 0.0 110.08 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.612 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -81.37 171.69 53.31 Favored Glycine 0 C--N 1.345 1.052 0 O-C-N 123.654 0.596 . . . . 0.0 112.685 175.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -41.18 -34.05 0.42 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.589 1.156 . . . . 0.0 112.398 163.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.405 ' H ' ' HG2' ' A' ' 34' ' ' GLU . 6.5 pt-20 -93.21 105.64 17.7 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -71.25 -14.42 62.23 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -168.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -65.14 -31.04 72.03 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.207 0.603 . . . . 0.0 110.086 172.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.72 87.84 1.72 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.3 m -121.66 127.66 51.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.655 0.782 . . . . 0.0 110.042 -176.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -140.0 131.26 26.62 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.543 1.137 . . . . 0.0 108.042 -178.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.449 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.8 pt-20 -119.01 125.15 48.7 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.63 153.87 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.56 -171.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 m -91.42 108.68 20.06 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.451 HD21 HD22 ' A' ' 49' ' ' LEU . 23.1 tp -107.1 124.75 50.13 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 122.872 0.469 . . . . 0.0 109.746 175.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.602 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 43.1 m -72.52 134.99 45.54 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.641 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.0 ptm180 -73.55 -11.32 60.4 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -171.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -92.45 -17.58 24.37 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.865 0.866 . . . . 0.0 110.325 171.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -94.18 143.88 27.12 Favored Pre-proline 0 C--N 1.354 0.761 0 C-N-CA 124.013 0.925 . . . . 0.0 109.701 -178.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.478 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -72.81 160.57 45.86 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.706 2.271 . . . . 0.0 112.928 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.514 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.1 mm? -56.64 -23.94 44.84 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.399 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -37.55 73.77 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -71.0 -27.88 64.02 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.008 0.433 . . . . 0.0 110.911 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -74.0 -41.18 62.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.945 0.898 . . . . 0.0 110.286 172.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -55.35 -44.28 75.81 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.057 0.943 . . . . 0.0 110.781 176.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -72.26 -35.97 68.92 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.443 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -70.22 -48.11 58.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.263 0.625 . . . . 0.0 110.537 -175.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.3 -58.85 6.03 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.349 1.06 . . . . 0.0 111.621 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.541 ' HA ' HD23 ' A' ' 62' ' ' LEU . 13.8 pt-20 -58.59 -28.71 65.84 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.913 0.758 . . . . 0.0 112.409 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.56 -40.65 63.78 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.22 -52.23 66.44 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -172.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.47 36.75 1.95 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 122.102 -0.374 . . . . 0.0 110.46 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 38.43 52.8 2.31 Favored Glycine 0 CA--C 1.541 1.658 0 N-CA-C 116.235 1.254 . . . . 0.0 116.235 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.541 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.0 mm? -77.59 9.23 3.51 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.378 0.671 . . . . 0.0 111.583 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.6 p -61.59 95.55 0.05 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.327 1.051 . . . . 0.0 110.062 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.1 -48.0 0.32 Allowed Glycine 0 C--N 1.338 0.647 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 -175.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.3 mtm105 -131.58 128.12 38.55 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.08 138.85 31.14 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.44 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -117.89 154.24 32.19 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.224 1.01 . . . . 0.0 110.374 -173.149 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.44 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 16.4 m -84.47 161.12 20.4 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.514 0.726 . . . . 0.0 110.623 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.428 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 32.0 m-85 -128.13 127.54 43.21 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.012 0.925 . . . . 0.0 109.156 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -123.08 137.13 55.01 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.77 0.828 . . . . 0.0 110.764 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.535 ' HB3' HD21 ' A' ' 76' ' ' LEU . 28.2 t80 -116.79 110.52 18.51 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.731 1.212 . . . . 0.0 108.318 174.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.1 t70 52.5 39.06 27.16 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-O 121.815 0.817 . . . . 0.0 111.019 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 71.52 22.52 78.62 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 114.91 -1.041 . . . . 0.0 114.656 -177.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.3 m -102.98 120.44 40.64 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.085 0.954 . . . . 0.0 109.128 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.0 114.99 6.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.91 0.484 . . . . 0.0 110.229 177.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.535 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.2 mt -84.6 120.89 26.88 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 27.4 m -77.13 -35.47 56.19 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.777 0.831 . . . . 0.0 112.509 -175.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.73 7.02 13.85 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 123.291 0.472 . . . . 0.0 113.49 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -127.59 10.89 6.71 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 124.036 0.934 . . . . 0.0 110.763 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.435 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.2 pm0 -105.08 147.84 27.45 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 174.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.99 154.17 37.45 Favored Pre-proline 0 C--N 1.311 -1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 108.579 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.641 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 44.7 Cg_endo -65.43 -29.35 53.69 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.749 1.632 . . . . 0.0 111.187 177.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.17 93.68 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.202 0.601 . . . . 0.0 110.596 172.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.03 -38.23 82.28 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.895 0.878 . . . . 0.0 111.909 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.435 HD21 ' HG3' ' A' ' 80' ' ' GLU . 70.2 mt -77.14 -24.77 51.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.649 0.779 . . . . 0.0 111.437 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.34 24.86 20.6 Favored Glycine 0 C--N 1.348 1.202 0 C-N-CA 122.036 -0.126 . . . . 0.0 113.035 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.514 ' HE1' HD11 ' A' ' 49' ' ' LEU . 63.1 mtt -74.76 170.63 15.48 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.304 1.041 . . . . 0.0 110.798 171.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -155.61 174.7 14.91 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 15.04 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -172.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.66 55.59 0.42 Allowed Glycine 0 C--N 1.342 0.903 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -106.97 -173.2 2.24 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.7 tp -140.02 134.74 31.84 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 121.72 0.771 . . . . 0.0 110.064 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.433 HD11 HD13 ' A' ' 28' ' ' LEU . 48.9 mt -127.94 151.95 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.558 1.543 . . . . 0.0 108.549 -178.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -116.78 165.04 13.76 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.504 1.121 . . . . 0.0 108.538 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.612 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 15.8 t -140.9 112.56 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.314 1.046 . . . . 0.0 108.805 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -115.28 98.01 6.52 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.495 1.118 . . . . 0.0 108.947 -176.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.41 ' HA3' ' HB3' ' A' ' 67' ' ' LEU . . . . . . . . 0 C--O 1.25 1.144 0 CA-C-O 118.917 -0.935 . . . . 0.0 111.136 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.516 ' HG3' HG22 ' A' ' 22' ' ' THR . 10.2 pt-20 -67.73 -34.96 77.87 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.244 0.618 . . . . 0.0 109.663 172.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.516 HG22 ' HG3' ' A' ' 21' ' ' GLU . 7.5 t -153.33 157.9 40.74 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.901 1.281 . . . . 0.0 108.116 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.4 t -66.2 -33.38 75.62 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.108 0.563 . . . . 0.0 111.857 -174.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -66.34 -14.74 62.52 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -171.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -113.72 152.5 30.43 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 111.464 -179.182 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt -113.29 150.16 32.89 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.787 1.635 . . . . 0.0 108.722 177.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.17 108.09 19.42 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.547 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.4 mm? -109.47 141.86 41.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -176.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -97.72 123.77 41.78 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.792 0.837 . . . . 0.0 109.42 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -110.17 116.6 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -177.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -132.06 139.06 48.41 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.744 0.418 . . . . 0.0 110.069 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.559 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -100.64 179.31 29.1 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 123.512 0.508 . . . . 0.0 113.892 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -50.73 -15.27 0.26 Allowed 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -97.63 144.88 26.85 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.478 0.711 . . . . 0.0 109.151 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -67.51 -30.25 69.87 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 165.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -58.6 -38.1 77.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.599 1.56 . . . . 0.0 111.623 174.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -89.0 87.05 7.07 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.242 -169.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -124.66 131.86 53.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.296 0.638 . . . . 0.0 109.803 167.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -140.33 126.14 19.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.84 127.09 51.59 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.543 0.687 . . . . 0.0 109.184 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -133.88 151.11 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.061 0.944 . . . . 0.0 111.474 -168.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 67.8 m -93.39 106.92 18.83 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.015 176.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 28' ' ' LEU . 28.9 tp -107.34 131.94 53.68 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.427 1.091 . . . . 0.0 109.309 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.518 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 35.1 m -77.8 144.64 36.94 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.655 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 11.9 ptm85 -71.05 -9.32 57.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.575 0.35 . . . . 0.0 111.934 -175.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -94.86 -30.84 13.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.415 1.086 . . . . 0.0 109.849 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 m -82.11 139.28 45.72 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.969 0.907 . . . . 0.0 109.962 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.547 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 16.4 Cg_exo -62.21 153.79 67.41 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.962 2.441 . . . . 0.0 113.6 177.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.7 mm? -53.59 -29.5 37.86 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.596 170.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.547 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -58.22 -36.96 73.93 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.08 0.552 . . . . 0.0 112.428 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.84 -33.23 75.36 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 120.976 0.417 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -73.29 -42.61 62.21 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.929 1.292 . . . . 0.0 110.792 173.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.436 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 65.9 mtt -57.06 -46.04 82.76 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.444 1.098 . . . . 0.0 110.503 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 p -69.67 -33.78 73.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.272 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.46 -52.19 59.26 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.625 0.77 . . . . 0.0 110.538 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.431 ' CZ ' HG21 ' A' ' 95' ' ' VAL . 52.5 t80 -52.92 -60.2 3.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 111.831 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.519 ' HA ' HD23 ' A' ' 62' ' ' LEU . 7.9 pt-20 -57.87 -34.19 69.5 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 124.283 0.99 . . . . 0.0 111.986 -177.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.81 -47.4 85.29 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 173.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.05 -43.47 73.84 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -112.72 30.14 7.38 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 122.487 0.315 . . . . 0.0 110.998 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 39.49 47.99 2.95 Favored Glycine 0 N--CA 1.481 1.693 0 N-CA-C 117.275 1.67 . . . . 0.0 117.275 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.0 mm? -73.17 82.88 1.32 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.713 . . . . 0.0 110.098 175.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.5 p -102.22 -58.28 1.91 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.967 0.907 . . . . 0.0 110.249 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.75 -36.5 61.73 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.887 -179.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -106.91 97.65 7.41 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -94.22 145.5 24.67 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.459 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -127.06 165.71 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.728 0.811 . . . . 0.0 111.434 -164.852 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.9 m -99.64 152.99 19.44 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.702 0.801 . . . . 0.0 110.169 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -115.59 127.25 55.09 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.751 0.82 . . . . 0.0 109.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -122.79 140.96 52.35 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.931 0.892 . . . . 0.0 110.005 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.508 ' HB3' HD21 ' A' ' 76' ' ' LEU . 67.2 t80 -129.74 114.17 15.64 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.941 0.896 . . . . 0.0 108.661 174.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 56.61 34.29 24.2 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.382 1.073 . . . . 0.0 110.459 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 79.09 -2.65 68.97 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.397 -0.819 . . . . 0.0 114.243 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 97.1 m -81.49 126.87 32.19 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 117.663 0.731 . . . . 0.0 110.233 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -71.27 116.02 11.11 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 123.735 0.647 . . . . 0.0 109.65 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.508 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.6 mt -87.51 130.32 34.76 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -92.45 -25.0 18.65 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.659 0.784 . . . . 0.0 111.489 -177.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.93 -41.56 1.77 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 123.167 0.413 . . . . 0.0 113.092 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -76.71 -18.75 58.32 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.985 0.914 . . . . 0.0 112.591 -170.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.53 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.8 pm0 -71.99 149.1 45.29 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.6 mt -103.95 152.02 38.99 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.655 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 43.3 Cg_endo -64.03 -21.94 68.12 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.06 1.84 . . . . 0.0 111.708 -178.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.56 -44.35 89.66 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.054 0.941 . . . . 0.0 111.588 171.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -74.72 -39.71 61.74 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.614 0.766 . . . . 0.0 111.535 -176.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.53 HD21 ' HG3' ' A' ' 80' ' ' GLU . 95.0 mt -69.81 -23.27 63.3 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.07 0.548 . . . . 0.0 111.476 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.91 55.8 3.24 Favored Glycine 0 C--N 1.344 0.977 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 -174.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.444 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 61.0 mtp -107.74 159.62 16.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.075 0.95 . . . . 0.0 109.33 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -148.59 165.94 29.76 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.7 t -59.92 108.65 0.79 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 131.52 -31.95 3.02 Favored Glycine 0 C--N 1.354 1.534 0 CA-C-O 119.363 -0.687 . . . . 0.0 113.669 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.409 ' HB2' HD12 ' A' ' 28' ' ' LEU . 1.2 m-20 -54.15 167.24 0.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -177.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.7 tp -131.61 110.48 10.97 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 121.468 0.652 . . . . 0.0 109.538 -162.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.42 HD11 ' HE1' ' A' ' 87' ' ' MET . 38.3 mt -90.65 148.75 4.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.354 173.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -114.92 156.91 24.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -171.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.559 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 19.0 t -135.04 109.23 11.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -102.86 94.03 5.37 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.398 -1.273 . . . . 0.0 108.043 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.896 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -178.824 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -141.09 -17.62 0.82 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -166.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -61.38 119.89 9.39 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 121.165 1.802 . . . . 0.0 111.346 -135.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 t -100.29 130.78 46.44 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 110.896 -2.866 . . . . 0.0 115.611 -134.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -80.41 -54.88 5.3 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 155.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -130.69 152.67 49.8 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.225 1.01 . . . . 0.0 109.963 175.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.3 mt -97.1 123.54 40.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.449 1.5 . . . . 0.0 107.734 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -85.73 103.26 14.36 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -178.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 44.2 mt -111.25 132.87 54.01 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -175.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 mtt85 -99.48 126.86 45.49 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.95 133.03 52.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.704 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -139.9 153.43 46.97 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.884 0.873 . . . . 0.0 108.936 174.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.546 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -91.75 -170.62 41.87 Favored Glycine 0 C--N 1.34 0.764 0 O-C-N 123.526 0.516 . . . . 0.0 112.635 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -37.5 -39.94 0.35 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.084 0.954 . . . . 0.0 111.801 157.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -89.92 112.67 24.13 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 168.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.58 -17.56 62.29 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 120.73 0.3 . . . . 0.0 110.825 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -71.65 -27.88 63.38 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.401 0.68 . . . . 0.0 110.09 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -76.04 87.57 2.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.5 m -115.13 136.99 52.52 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.515 0.726 . . . . 0.0 110.894 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 tp -137.71 134.88 35.89 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -109.77 125.36 52.62 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -134.26 146.68 30.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.794 0.838 . . . . 0.0 110.605 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.7 p -95.55 107.68 19.87 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 175.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HB2' HD12 ' A' ' 52' ' ' LEU . 26.5 tp -88.49 131.14 35.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.547 -0.752 . . . . 0.0 108.992 175.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -73.82 139.88 45.41 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -61.91 -27.94 69.18 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.471 0.708 . . . . 0.0 112.477 -171.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -86.85 -27.76 23.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.101 0.96 . . . . 0.0 111.277 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -84.9 133.78 42.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.484 0.714 . . . . 0.0 110.842 -168.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.546 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 6.1 Cg_exo -60.09 157.05 36.22 Favored 'Trans proline' 0 C--N 1.378 2.113 0 C-N-CA 122.74 2.293 . . . . 0.0 113.085 177.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.489 HD11 ' HE1' ' A' ' 87' ' ' MET . 4.0 mm? -55.02 -26.98 40.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.581 1.152 . . . . 0.0 112.236 176.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.0 pttt -59.49 -33.3 71.16 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 48' ' ' PRO . 3.0 t -68.76 -32.48 72.25 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.343 0.592 . . . . 0.0 110.21 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' ' 43' ' ' LEU . 7.0 tt -74.15 -38.69 63.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.925 1.29 . . . . 0.0 110.376 173.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.9 mtt -59.04 -41.29 87.48 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.014 0.926 . . . . 0.0 110.592 176.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 24.1 m -64.44 -41.85 96.33 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 124.634 1.209 . . . . 0.0 109.789 176.033 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.42 -50.1 74.2 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.074 0.55 . . . . 0.0 110.495 -176.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -55.42 -58.01 9.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.958 0.903 . . . . 0.0 112.178 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.98 -39.1 93.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.982 -174.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 54' ' ' SER . 30.6 mm-40 -65.76 -46.33 79.19 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.25 60.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.302 1.041 . . . . 0.0 113.566 -171.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtm -104.06 36.73 2.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.731 0.412 . . . . 0.0 111.546 -174.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 43.85 53.59 6.26 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -87.04 45.99 1.33 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.631 0.772 . . . . 0.0 109.141 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.5 m -74.01 124.35 26.07 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.811 0.844 . . . . 0.0 110.807 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.84 -58.14 3.3 Favored Glycine 0 C--N 1.344 1.008 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -178.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 45.8 mtm105 -75.29 101.61 4.76 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.342 0.657 . . . . 0.0 110.426 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 tppt? -79.63 148.27 31.72 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 172.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.49 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.93 155.33 45.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.161 0.984 . . . . 0.0 109.599 -177.076 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 17.5 m -85.68 150.69 24.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.484 0.714 . . . . 0.0 110.347 -176.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -119.89 130.11 54.69 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.711 0.804 . . . . 0.0 109.88 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.451 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 17.6 m-85 -124.63 155.59 38.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.009 0.924 . . . . 0.0 110.335 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.516 ' HB3' HD21 ' A' ' 76' ' ' LEU . 56.9 t80 -140.25 112.32 7.65 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.37 1.068 . . . . 0.0 108.956 172.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 57.3 32.12 21.23 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.355 1.062 . . . . 0.0 110.995 -174.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.22 -0.45 89.71 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.645 -1.161 . . . . 0.0 114.28 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 86.3 m -83.54 122.12 28.14 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.346 0.658 . . . . 0.0 110.084 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -67.42 114.32 6.01 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.516 HD21 ' HB3' ' A' ' 71' ' ' PHE . 30.6 mt -86.42 118.93 26.17 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -78.77 -30.56 45.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.72 0.808 . . . . 0.0 112.473 -176.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.6 -47.28 1.03 Allowed Glycine 0 CA--C 1.524 0.604 0 CA-C-N 116.302 -0.408 . . . . 0.0 112.827 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -77.09 -19.74 56.64 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.439 0.696 . . . . 0.0 112.532 -169.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.469 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -69.58 149.03 48.61 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.792 0.806 . . . . 0.0 109.459 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 65.3 mt -101.96 157.4 33.77 Favored Pre-proline 0 C--N 1.309 -1.194 0 C-N-CA 125.17 1.388 . . . . 0.0 108.626 -174.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -65.24 -35.02 42.96 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 121.827 1.685 . . . . 0.0 111.515 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.31 -36.39 79.99 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.716 0.806 . . . . 0.0 111.163 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.66 -46.55 75.35 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.995 0.918 . . . . 0.0 111.473 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.469 HD21 ' HG3' ' A' ' 80' ' ' GLU . 55.6 mt -75.34 -17.1 60.33 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.22 22.73 53.87 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.132 -0.486 . . . . 0.0 113.111 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.489 ' HE1' HD11 ' A' ' 49' ' ' LEU . 48.5 mtt -64.51 152.16 42.52 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.339 1.056 . . . . 0.0 112.165 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -146.91 157.23 43.58 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 -175.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 54.7 p -56.6 117.42 3.86 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.194 0.598 . . . . 0.0 111.173 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.09 -8.65 29.2 Favored Glycine 0 C--N 1.34 0.758 0 CA-C-O 119.603 -0.554 . . . . 0.0 113.501 178.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -60.06 160.33 8.21 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 117.446 0.623 . . . . 0.0 111.868 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.2 tp -124.77 108.79 12.34 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -163.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.6 mt -88.63 150.03 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 39.8 mt-10 -112.26 155.32 24.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.502 1.121 . . . . 0.0 108.216 -171.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.546 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 41.7 t -136.02 107.45 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.763 0.825 . . . . 0.0 108.836 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 9.7 m0 -101.85 97.58 7.94 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -177.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.141 -176.723 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -159.73 162.57 34.98 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 -171.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -74.83 150.51 39.25 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 169.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.3 m 60.54 29.73 19.23 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 124.395 1.078 . . . . 0.0 112.197 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -82.26 -14.12 55.97 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.57 0.748 . . . . 0.0 111.362 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.461 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 8.6 mp0 -81.56 131.37 35.27 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.107 -167.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 69.9 mt -97.0 125.85 41.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.28 1.032 . . . . 0.0 108.256 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -77.26 99.0 5.33 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.6 mt -112.39 133.72 54.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.481 0.712 . . . . 0.0 109.598 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -96.5 136.39 37.07 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.437 HG13 ' HB ' ' A' ' 93' ' ' ILE . 1.9 t -125.01 134.05 67.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -132.6 146.96 52.3 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 118.221 0.464 . . . . 0.0 110.496 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.593 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -97.06 174.13 29.75 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 124.023 0.827 . . . . 0.0 112.26 171.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -50.69 -19.45 0.94 Allowed 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 173.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -94.09 155.25 17.19 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.455 0.702 . . . . 0.0 110.179 -176.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.93 -47.08 72.8 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.685 0.794 . . . . 0.0 112.847 -171.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -87.94 -17.31 31.59 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.374 0.67 . . . . 0.0 110.935 -176.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' HG3' ' OH ' ' A' ' 56' ' ' TYR . 5.7 tp-100 -69.48 84.36 0.41 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.103 0.561 . . . . 0.0 109.581 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.9 m -138.24 131.74 30.7 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.372 1.069 . . . . 0.0 109.146 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -140.76 132.57 27.46 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -120.88 129.48 53.52 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -174.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.4 p -132.14 149.53 32.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.841 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.2 p -94.98 105.78 17.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.0 tp -108.09 107.55 18.25 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.697 177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 26.9 m -32.92 120.49 0.35 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 113.093 158.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.647 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.7 ptm180 -64.03 -13.61 48.22 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -172.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 44.5 p-10 -98.68 -14.22 19.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.163 0.985 . . . . 0.0 111.092 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m -92.82 141.05 23.85 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.038 0.935 . . . . 0.0 110.124 -175.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.555 ' O ' HG22 ' A' ' 51' ' ' THR . 14.6 Cg_exo -61.12 149.33 89.69 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.313 2.675 . . . . 0.0 113.201 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.68 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.9 mm? -53.58 -29.86 39.37 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.036 -0.983 . . . . 0.0 112.336 172.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -54.89 -37.78 66.75 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.502 0.721 . . . . 0.0 112.307 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.555 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.4 t -69.42 -36.83 77.09 Favored 'General case' 0 CA--C 1.554 1.133 0 O-C-N 123.118 0.262 . . . . 0.0 110.58 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.01 -45.18 82.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.293 1.037 . . . . 0.0 110.531 175.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.495 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -54.94 -47.35 74.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.129 176.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 t -66.81 -33.79 76.4 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.463 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -67.29 -49.86 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.423 0.689 . . . . 0.0 110.159 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.449 ' CZ ' HG21 ' A' ' 95' ' ' VAL . 46.7 t80 -54.98 -60.77 2.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.167 0.987 . . . . 0.0 111.449 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.51 ' HA ' HD23 ' A' ' 62' ' ' LEU . 11.4 pt-20 -62.7 -39.38 93.81 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.549 -173.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.78 -37.75 85.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 175.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.36 -45.05 76.51 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -109.6 36.54 2.92 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 120.831 0.348 . . . . 0.0 110.617 177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 35.79 42.56 0.52 Allowed Glycine 0 N--CA 1.482 1.711 0 N-CA-C 118.326 2.09 . . . . 0.0 118.326 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 57' ' ' GLU . 2.8 mm? -72.35 88.45 1.18 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.902 0.851 . . . . 0.0 109.922 170.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -128.72 -20.5 3.54 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.378 0.671 . . . . 0.0 110.879 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.35 -32.16 71.82 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 174.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -137.36 145.65 43.58 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.032 0.933 . . . . 0.0 108.761 171.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -99.15 146.7 25.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 171.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.48 ' HB3' ' HA3' ' A' ' 97' ' ' GLY . 0.0 OUTLIER -126.51 152.7 46.15 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.575 0.75 . . . . 0.0 110.758 -172.258 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.427 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 50.0 m -89.46 162.62 15.64 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.105 -177.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.47 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 45.2 m-85 -132.27 128.12 37.13 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.489 1.116 . . . . 0.0 109.249 -174.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.523 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 31.6 m-85 -125.15 122.66 37.74 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.54 0.736 . . . . 0.0 110.636 -177.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.569 ' HB3' HD21 ' A' ' 76' ' ' LEU . 27.5 t80 -98.73 106.89 19.21 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 52.01 46.11 27.15 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.259 1.023 . . . . 0.0 111.618 -171.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 76.5 1.03 69.28 Favored Glycine 0 C--N 1.347 1.175 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.907 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 54.5 m -86.64 113.02 22.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.499 0.72 . . . . 0.0 109.303 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -59.02 115.4 3.12 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.818 0.698 . . . . 0.0 109.512 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 71' ' ' PHE . 56.6 mt -88.5 127.65 35.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.131 0.972 . . . . 0.0 108.863 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.4 t -81.44 -25.55 36.05 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.697 0.799 . . . . 0.0 111.422 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.74 -47.86 1.0 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 123.78 0.705 . . . . 0.0 112.436 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -93.97 11.28 30.19 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.665 0.786 . . . . 0.0 112.365 -168.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.558 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -85.88 150.17 24.71 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 165.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.1 mt -102.26 160.37 26.57 Favored Pre-proline 0 C--N 1.309 -1.184 0 C-N-CA 124.806 1.242 . . . . 0.0 107.922 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.647 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 36.7 Cg_endo -67.22 -20.08 49.79 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.423 1.415 . . . . 0.0 111.839 171.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.88 92.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.4 0.68 . . . . 0.0 110.564 168.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -75.2 -45.46 40.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.038 0.935 . . . . 0.0 110.723 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.558 HD21 ' HG3' ' A' ' 80' ' ' GLU . 96.0 mt -68.66 -23.97 64.48 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.029 0.932 . . . . 0.0 112.783 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 71.53 64.51 2.71 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.68 ' HE1' HD11 ' A' ' 49' ' ' LEU . 30.7 ttp -128.39 153.78 46.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.35 1.06 . . . . 0.0 108.721 -173.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -149.49 167.18 26.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.598 0.759 . . . . 0.0 109.1 -170.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 m -55.71 117.85 4.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.463 0.705 . . . . 0.0 111.323 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 120.94 -21.79 8.24 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-O 119.816 -0.435 . . . . 0.0 113.245 177.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.32 169.29 0.89 Allowed 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.61 110.51 9.95 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.917 -166.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.437 ' HB ' HG13 ' A' ' 30' ' ' VAL . 62.1 mt -95.46 150.29 4.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.415 175.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 34.9 mt-10 -109.96 165.06 12.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.038 0.935 . . . . 0.0 108.7 -171.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.593 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 46.0 t -139.89 109.49 3.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 123.995 0.918 . . . . 0.0 108.912 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -119.34 99.92 6.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.574 1.149 . . . . 0.0 108.69 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLY . . . . . 0.48 ' HA3' ' HB3' ' A' ' 67' ' ' LEU . . . . . . . . 0 C--O 1.249 1.071 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.456 HG21 HE22 ' A' ' 24' ' ' GLN . 40.1 p . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -117.7 -35.94 3.81 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.868 0.867 . . . . 0.0 112.02 -171.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.2 p -70.25 121.6 17.91 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 118.311 -0.852 . . . . 0.0 108.853 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -40.26 74.14 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 126.389 1.875 . . . . 0.0 115.487 -165.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.456 HE22 HG21 ' A' ' 20' ' ' THR . 9.1 tt0 -83.37 -35.14 25.35 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.811 2.044 . . . . 0.0 111.925 173.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.448 ' OE1' ' HB3' ' A' ' 42' ' ' SER . 3.9 pp0? -86.33 157.93 19.77 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.015 1.326 . . . . 0.0 112.892 -153.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.96 134.02 38.08 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.799 -160.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.62 103.37 15.76 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 45.2 mt -109.33 130.6 55.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.004 0.522 . . . . 0.0 109.935 -174.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -92.94 128.56 38.85 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.86 121.31 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -173.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -127.62 137.44 52.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.773 0.429 . . . . 0.0 109.887 -171.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.609 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -76.46 173.18 54.41 Favored Glycine 0 C--N 1.343 0.942 0 O-C-N 123.745 0.653 . . . . 0.0 112.46 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -41.93 -37.48 1.33 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.827 0.851 . . . . 0.0 112.073 164.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.455 ' HG2' ' H ' ' A' ' 34' ' ' GLU . 4.6 pt-20 -87.87 117.56 26.8 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.966 1.307 . . . . 0.0 108.358 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -71.16 -21.01 62.23 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.224 0.61 . . . . 0.0 111.876 -173.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -63.27 -30.8 71.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.533 0.733 . . . . 0.0 110.177 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -76.38 90.4 3.23 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.1 m -126.73 126.31 43.25 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.534 0.734 . . . . 0.0 109.445 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.68 122.83 20.4 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -115.46 122.72 46.63 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.025 0.917 . . . . 0.0 109.355 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.82 147.44 29.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.793 0 C-N-CA 125.045 1.338 . . . . 0.0 109.484 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.448 ' HB3' ' OE1' ' A' ' 25' ' ' GLN . 6.0 m -90.86 107.15 19.0 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 27.3 tp -104.71 131.61 51.95 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.749 0.82 . . . . 0.0 109.026 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.3 m -75.88 137.15 40.23 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.713 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 9.1 ptm180 -72.21 -6.79 45.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.742 0.306 . . . . 0.0 111.746 -175.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -92.4 -37.7 12.42 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.646 1.178 . . . . 0.0 109.887 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 m -78.01 132.55 67.06 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.599 0.76 . . . . 0.0 110.682 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.437 ' O ' HG22 ' A' ' 51' ' ' THR . 10.7 Cg_endo -64.54 162.07 32.6 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.545 2.163 . . . . 0.0 113.974 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.5 mm? -53.92 -28.03 34.32 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.433 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.83 -36.22 58.41 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -177.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 48' ' ' PRO . 10.9 t -73.26 -33.76 65.45 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 120.892 0.377 . . . . 0.0 111.129 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.72 -42.7 85.92 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.258 1.023 . . . . 0.0 110.322 172.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.41 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -58.63 -49.36 77.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.558 1.143 . . . . 0.0 110.636 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.8 p -67.15 -32.84 74.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 124.813 1.321 . . . . 0.0 109.778 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -67.43 -53.5 28.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 122.845 0.458 . . . . 0.0 110.065 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -55.27 -60.16 3.79 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.613 1.165 . . . . 0.0 111.389 -178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 53' ' ' MET . 12.3 pt-20 -56.91 -49.87 74.28 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.015 0.822 . . . . 0.0 110.901 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.26 -27.1 66.04 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.46 -43.24 97.1 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -109.12 27.0 9.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.663 0.385 . . . . 0.0 111.097 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 42.73 65.29 1.4 Allowed Glycine 0 N--CA 1.48 1.63 0 N-CA-C 116.582 1.393 . . . . 0.0 116.582 -177.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -90.33 9.78 27.49 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.605 1.162 . . . . 0.0 110.504 173.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.9 p -62.79 97.75 0.11 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.072 0.949 . . . . 0.0 110.651 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.87 -43.86 0.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -131.05 130.27 43.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 172.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -86.76 143.47 27.51 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -113.88 153.2 29.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.017 0.927 . . . . 0.0 109.998 -175.284 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 41.3 m -87.82 130.81 34.75 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.495 -173.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -101.64 133.05 46.94 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.121 0.969 . . . . 0.0 110.035 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.488 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 98.3 m-85 -128.73 132.39 47.97 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.306 0.642 . . . . 0.0 111.175 177.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.473 ' HB3' HD21 ' A' ' 76' ' ' LEU . 15.7 t80 -120.63 108.52 14.12 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.6 t70 59.5 26.22 15.15 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-O 122.045 0.926 . . . . 0.0 110.456 -172.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.75 -2.9 87.33 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.517 -0.765 . . . . 0.0 114.272 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.44 ' O ' ' HA ' ' A' ' 70' ' ' PHE . 90.9 m -73.51 125.92 29.04 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 117.581 0.69 . . . . 0.0 110.197 175.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -68.66 114.03 6.67 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 123.62 0.575 . . . . 0.0 109.64 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.473 HD21 ' HB3' ' A' ' 71' ' ' PHE . 12.2 mt -93.95 124.59 38.05 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 175.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.2 m -111.56 -14.19 13.71 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.31 -63.17 0.54 Allowed Glycine 0 C--N 1.345 1.065 0 N-CA-C 113.599 0.2 . . . . 0.0 113.599 176.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -77.8 -5.14 49.79 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -167.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.4 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.6 pm0 -81.43 147.63 29.67 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 17.6 mt -99.6 153.16 37.91 Favored Pre-proline 0 C--N 1.312 -1.056 0 C-N-CA 125.343 1.457 . . . . 0.0 108.128 -176.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.713 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 50.0 Cg_endo -66.29 -36.23 28.74 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 121.768 1.645 . . . . 0.0 111.317 177.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.14 75.2 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.083 0.553 . . . . 0.0 110.966 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -65.94 -43.7 87.26 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.778 . . . . 0.0 110.624 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.4 HD21 ' HG3' ' A' ' 80' ' ' GLU . 50.6 mt -74.85 -24.83 58.65 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.63 0.772 . . . . 0.0 111.999 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 91.47 55.21 1.83 Allowed Glycine 0 C--N 1.343 0.919 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 63.4 mtt -104.34 161.87 13.7 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.986 0.914 . . . . 0.0 110.653 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.5 tp10 -148.9 160.42 43.27 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.928 0.891 . . . . 0.0 108.689 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 t -62.66 118.07 7.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.347 0.659 . . . . 0.0 110.72 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.34 41.19 3.04 Favored Glycine 0 C--N 1.34 0.771 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -173.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.5 t0 -103.9 -175.75 2.89 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.338 0.655 . . . . 0.0 109.444 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 30.9 tp -138.66 134.79 34.14 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.472 0.653 . . . . 0.0 109.447 -174.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 54.1 mt -126.54 150.39 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.923 1.289 . . . . 0.0 108.194 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.488 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 28.5 mt-10 -117.88 156.4 28.49 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 -171.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.609 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 10.2 t -140.14 139.41 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.567 0.747 . . . . 0.0 110.265 -174.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.1 m95 -135.73 95.08 3.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.812 1.245 . . . . 0.0 109.653 -175.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.3 0 CA-C-O 118.946 -0.919 . . . . 0.0 111.87 -176.786 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.484 1.227 0 CA-C-O 120.687 0.28 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -100.2 -12.63 19.41 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.417 0.687 . . . . 0.0 110.898 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.5 p -68.31 121.45 16.29 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -46.36 81.47 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.821 1.649 . . . . 0.0 114.738 -163.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.48 ' O ' ' HD2' ' A' ' 45' ' ' ARG . 1.3 pp0? -80.3 -38.15 31.33 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.396 -1.275 . . . . 0.0 107.869 165.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -89.53 154.33 20.09 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 113.849 -1.523 . . . . 0.0 110.303 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 82' ' ' PRO . 44.6 mt -99.01 123.36 43.25 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.306 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -87.28 101.87 13.95 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.632 HD13 ' SD ' ' A' ' 87' ' ' MET . 28.2 mt -113.55 154.7 26.68 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.498 0.719 . . . . 0.0 111.203 -168.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.6 mtm105 -112.19 136.28 51.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.188 0.595 . . . . 0.0 110.955 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -120.29 126.04 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.216 1.407 . . . . 0.0 108.899 173.585 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -129.12 129.16 44.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.622 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -89.98 175.11 41.36 Favored Glycine 0 C--N 1.344 0.991 0 O-C-N 123.729 0.643 . . . . 0.0 113.63 -172.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -39.66 -37.15 0.48 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.07 1.348 . . . . 0.0 113.932 167.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -75.09 122.61 23.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -63.84 -31.93 73.28 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.538 0.735 . . . . 0.0 111.987 -176.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -76.34 -26.65 55.97 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.447 0.699 . . . . 0.0 110.76 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.4 ' OE1' ' HB2' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -67.03 94.94 0.36 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 -179.126 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.1 m -115.74 119.31 35.62 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 169.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.464 ' HB3' HG23 ' A' ' 30' ' ' VAL . 1.5 tm? -128.57 128.13 43.67 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -121.16 121.31 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.765 0.793 . . . . 0.0 109.542 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -128.15 144.83 36.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 124.817 1.247 . . . . 0.0 110.823 -171.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p -93.39 112.17 24.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.814 0.845 . . . . 0.0 109.489 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.445 ' HB3' HD12 ' A' ' 28' ' ' LEU . 36.8 tp -110.09 133.9 52.73 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.924 0.889 . . . . 0.0 109.41 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 67.3 m -77.18 147.08 36.66 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.656 0.382 . . . . 0.0 109.992 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.496 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 8.9 ptm180 -64.62 -25.9 68.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.663 0.785 . . . . 0.0 111.853 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -99.69 -16.05 18.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.258 1.023 . . . . 0.0 111.096 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.2 m -88.42 135.99 32.08 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.701 0.8 . . . . 0.0 109.438 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.524 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 2.8 Cg_endo -65.9 155.03 71.47 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 122.697 2.265 . . . . 0.0 113.283 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.04 -29.9 32.53 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 125.137 1.375 . . . . 0.0 112.255 176.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.524 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.2 pttt -55.96 -35.47 66.74 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.0 t -70.3 -32.85 70.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.0 tt -70.85 -37.6 73.12 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.599 1.16 . . . . 0.0 110.235 173.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.2 mtt -61.99 -42.09 98.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.01 0.924 . . . . 0.0 110.397 176.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.5 m -66.92 -38.58 86.47 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 124.534 1.146 . . . . 0.0 110.227 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.76 -45.6 70.98 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 122.989 0.516 . . . . 0.0 110.311 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.83 -57.96 9.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.219 1.008 . . . . 0.0 111.8 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.43 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 11.5 pt-20 -61.1 -42.51 98.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 123.946 0.779 . . . . 0.0 110.512 -174.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.58 -29.48 70.08 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.41 -51.68 66.06 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -109.18 29.83 7.15 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 122.469 0.308 . . . . 0.0 111.416 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 44.97 64.79 2.04 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.43 ' HB2' ' HB2' ' A' ' 57' ' ' GLU . 3.9 mm? -91.19 20.44 5.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.302 1.041 . . . . 0.0 111.471 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.6 p -74.25 82.38 1.85 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 121.449 0.642 . . . . 0.0 109.743 174.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.49 -27.89 1.5 Allowed Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.197 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -126.46 95.46 4.37 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.33 1.052 . . . . 0.0 108.32 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -89.41 142.98 27.18 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.557 0.343 . . . . 0.0 110.233 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -129.82 162.03 29.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.525 1.13 . . . . 0.0 110.85 -170.587 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.0 m -98.16 168.09 10.47 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.253 0.621 . . . . 0.0 111.156 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -130.99 132.12 44.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.159 1.383 . . . . 0.0 109.007 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -127.73 112.4 14.76 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.753 0.821 . . . . 0.0 110.603 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.531 ' HB3' HD21 ' A' ' 76' ' ' LEU . 10.8 t80 -102.23 111.72 24.11 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.677 1.191 . . . . 0.0 107.819 174.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.4 t70 52.47 36.16 19.52 Favored 'General case' 0 CA--C 1.564 1.495 0 CA-C-O 121.977 0.894 . . . . 0.0 110.836 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 85.75 -16.12 43.21 Favored Glycine 0 N--CA 1.478 1.466 0 CA-C-N 115.062 -0.972 . . . . 0.0 114.745 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.5 m -70.51 121.0 16.99 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.287 0.635 . . . . 0.0 110.789 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -71.23 119.71 15.75 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.531 HD21 ' HB3' ' A' ' 71' ' ' PHE . 45.0 mt -91.37 126.82 36.58 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 124.289 1.036 . . . . 0.0 109.403 -177.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.7 m -90.35 -22.97 21.25 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.892 0.877 . . . . 0.0 112.38 -176.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.21 -49.72 0.92 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 120.103 -0.276 . . . . 0.0 113.604 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.4 mtm180 -82.54 1.29 38.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.703 0.801 . . . . 0.0 112.866 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.422 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -85.26 148.12 26.22 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.4 156.8 34.82 Favored Pre-proline 0 C--N 1.313 -1.0 0 C-N-CA 125.045 1.338 . . . . 0.0 108.097 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 73.7 Cg_endo -69.32 -25.06 31.01 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 121.531 1.487 . . . . 0.0 111.126 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.48 83.97 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.324 0.649 . . . . 0.0 110.56 171.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -67.11 -40.5 86.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.422 ' HB3' ' CE2' ' A' ' 71' ' ' PHE . 88.5 mt -73.55 -23.61 60.0 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.198 0.999 . . . . 0.0 111.902 176.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.78 23.68 52.11 Favored Glycine 0 C--N 1.349 1.288 0 O-C-N 123.236 0.335 . . . . 0.0 112.858 -176.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.632 ' SD ' HD13 ' A' ' 28' ' ' LEU . 32.8 ttm -73.85 160.66 31.11 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.388 1.475 . . . . 0.0 110.848 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -140.04 157.19 46.04 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.094 0.957 . . . . 0.0 109.548 -176.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.5 m -56.45 119.49 6.13 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.358 0.663 . . . . 0.0 111.119 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.46 -15.37 32.47 Favored Glycine 0 N--CA 1.475 1.262 0 CA-C-O 119.727 -0.485 . . . . 0.0 113.91 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.64 175.85 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.54 1.136 . . . . 0.0 112.561 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.4 tp -130.79 107.66 9.3 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -172.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.1 mt -89.75 149.85 3.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 168.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -115.79 163.45 15.82 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.622 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 98.8 t -135.76 119.61 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -130.04 111.17 12.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.362 1.065 . . . . 0.0 109.333 -176.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.099 0 CA-C-O 119.263 -0.743 . . . . 0.0 113.127 -176.363 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.574 0.702 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.57 -40.97 0.87 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.154 0.982 . . . . 0.0 110.552 -169.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -90.31 123.15 33.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.402 1.081 . . . . 0.0 108.149 170.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -67.72 70.95 0.13 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -171.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -81.43 -36.15 29.79 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.613 1.565 . . . . 0.0 108.225 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -87.37 156.12 19.74 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 113.369 -1.741 . . . . 0.0 111.941 -162.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.9 mt -92.71 128.39 38.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.26 -163.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -83.85 99.82 10.57 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.479 HD13 ' SD ' ' A' ' 87' ' ' MET . 64.9 mt -110.89 130.77 55.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.868 0.867 . . . . 0.0 109.63 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 -99.15 112.11 24.33 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.018 0.527 . . . . 0.0 109.855 -176.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -100.48 119.65 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.914 0.886 . . . . 0.0 109.435 176.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -123.27 134.69 54.07 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -174.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.44 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -65.96 157.15 49.03 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 173.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.2 pttm -53.64 -20.76 5.68 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.037 0.919 . . . . 0.0 112.299 173.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -70.59 108.92 4.58 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 163.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -58.91 -33.21 70.29 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -167.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -84.84 -11.67 55.19 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.09 104.58 7.66 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 173.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 40.8 m -121.72 128.73 52.12 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.151 0.98 . . . . 0.0 109.964 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -129.44 121.06 26.54 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -113.24 125.3 54.16 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.286 0.565 . . . . 0.0 109.72 -176.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -132.34 148.39 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.736 1.214 . . . . 0.0 110.599 -174.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.4 p -102.29 105.24 15.84 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.464 ' HB3' HD12 ' A' ' 28' ' ' LEU . 34.2 tp -91.53 135.84 33.56 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.573 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.4 m -74.19 136.69 42.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.468 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.7 ptm180 -71.51 -15.82 62.32 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -168.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.408 ' O ' HD22 ' A' ' 81' ' ' LEU . 28.8 t70 -92.67 -36.73 12.79 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.988 0.915 . . . . 0.0 110.336 172.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -66.71 143.0 97.88 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 123.545 0.738 . . . . 0.0 111.249 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.457 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -71.62 162.74 41.2 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.616 2.211 . . . . 0.0 113.1 176.873 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -56.06 -26.12 47.98 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.731 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.457 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 62.2 pttt -58.32 -37.53 75.27 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.44 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -70.56 -30.77 67.58 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 118.439 0.563 . . . . 0.0 110.82 178.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.99 -40.74 78.58 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.176 0.991 . . . . 0.0 110.428 172.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.41 -45.13 89.02 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.283 1.033 . . . . 0.0 110.046 175.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -66.28 -35.95 81.72 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 124.993 1.433 . . . . 0.0 110.703 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -68.88 -47.43 65.88 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.097 0.559 . . . . 0.0 110.258 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.36 -59.05 5.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.473 1.109 . . . . 0.0 111.819 177.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 53' ' ' MET . 10.5 pt-20 -62.54 -46.6 87.64 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.349 1.03 . . . . 0.0 111.401 -174.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -65.54 -34.53 78.47 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.28 76.06 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.491 0.716 . . . . 0.0 112.301 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 64.6 mtm -112.59 29.12 8.2 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.123 0.569 . . . . 0.0 111.743 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 41.77 67.76 0.78 Allowed Glycine 0 CA--C 1.545 1.909 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 57' ' ' GLU . 4.2 mm? -90.53 47.82 1.47 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.548 0.739 . . . . 0.0 111.093 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.0 p -71.18 124.44 24.47 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.397 174.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.43 -63.42 4.15 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -68.34 90.44 0.36 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.299 0.639 . . . . 0.0 110.19 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tppt? -101.57 147.37 26.48 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.41 HD11 ' HG ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -128.91 169.23 14.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.172 0.989 . . . . 0.0 111.21 -166.7 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.5 m -104.71 166.36 10.44 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.031 0.932 . . . . 0.0 110.451 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.427 ' HB3' HD12 ' A' ' 76' ' ' LEU . 65.2 m-85 -136.08 129.65 32.2 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.883 1.273 . . . . 0.0 108.722 -179.083 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.73 133.93 50.77 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.584 0.753 . . . . 0.0 111.023 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.466 ' HB3' HD21 ' A' ' 76' ' ' LEU . 54.2 t80 -129.13 116.61 19.49 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.533 1.133 . . . . 0.0 108.292 171.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.5 t70 59.05 30.47 20.28 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.492 1.117 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 87.68 -19.78 31.25 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 113.37 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.8 m -65.29 120.14 12.21 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.621 0.768 . . . . 0.0 110.494 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -68.88 113.52 6.38 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 71' ' ' PHE . 31.7 mt -82.62 119.44 24.28 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -85.94 -31.02 22.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.366 1.066 . . . . 0.0 112.315 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.7 10.49 23.04 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.803 -172.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -123.54 10.46 9.12 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.538 1.135 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -112.45 148.08 35.15 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.408 HD22 ' O ' ' A' ' 46' ' ' ASP . 14.7 mt -102.21 156.65 34.98 Favored Pre-proline 0 C--N 1.313 -0.991 0 C-N-CA 125.37 1.468 . . . . 0.0 107.767 177.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.5 Cg_endo -67.57 -21.43 46.03 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.407 1.405 . . . . 0.0 110.894 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.2 76.25 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.017 0.927 . . . . 0.0 110.719 170.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.08 -42.35 89.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.016 0.926 . . . . 0.0 111.431 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.8 mt -74.18 -24.47 59.38 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 76.37 68.7 1.49 Allowed Glycine 0 C--N 1.351 1.374 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -173.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.479 ' SD ' HD13 ' A' ' 28' ' ' LEU . 43.8 ttm -118.65 160.19 22.26 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.47 1.108 . . . . 0.0 109.8 -172.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -124.03 166.14 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.275 0.63 . . . . 0.0 109.986 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 t -76.63 15.22 0.66 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.172 0.989 . . . . 0.0 113.174 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -151.94 55.98 0.45 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -103.71 -175.05 2.69 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.033 -173.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.4 tp -143.84 107.38 4.61 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.5 mt -94.22 150.09 4.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.903 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -105.6 158.25 16.82 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.44 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.2 t -136.87 124.46 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -124.82 99.27 6.07 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.618 0.767 . . . . 0.0 109.695 -176.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 177.005 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.77 0.319 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -99.35 -37.04 9.4 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.984 0.913 . . . . 0.0 109.246 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.5 t -110.39 121.53 45.52 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 169.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.0 m -81.85 70.2 8.7 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -79.5 -38.84 33.47 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 162.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -124.97 151.64 45.22 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 114.475 -1.239 . . . . 0.0 109.307 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.6 mt -107.32 134.84 49.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.918 1.287 . . . . 0.0 108.626 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -83.06 101.36 11.08 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 43' ' ' LEU . 90.3 mt -110.51 124.21 51.38 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.956 0.502 . . . . 0.0 111.225 -170.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -87.68 138.12 31.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.188 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.57 124.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 125.238 1.415 . . . . 0.0 108.103 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -122.97 129.05 51.05 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -175.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.668 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -74.74 172.86 52.58 Favored Glycine 0 C--N 1.342 0.877 0 N-CA-C 114.739 0.656 . . . . 0.0 114.739 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -36.03 -39.89 0.18 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.129 1.372 . . . . 0.0 112.453 157.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -81.67 99.12 8.72 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -68.04 -22.45 64.96 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -171.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -70.18 -28.73 65.55 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.904 0.882 . . . . 0.0 110.523 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -71.9 112.63 8.16 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.205 0.602 . . . . 0.0 109.401 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 39.8 m -128.04 126.32 41.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.737 0.815 . . . . 0.0 108.894 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -128.01 136.86 51.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -125.23 128.27 48.04 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.055 0.843 . . . . 0.0 110.272 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -133.96 144.25 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.451 1.1 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.2 m -94.14 107.23 19.17 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 28' ' ' LEU . 43.1 tp -93.48 134.97 35.18 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.009 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.3 m -77.68 141.2 39.52 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.457 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.1 ptm180 -63.4 -26.05 68.57 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.15 -15.98 24.15 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.784 0.834 . . . . 0.0 110.621 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.0 m -88.74 132.84 37.28 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.489 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -69.0 163.61 37.0 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.484 2.122 . . . . 0.0 113.359 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.43 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.1 mm? -57.26 -26.37 60.69 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.882 177.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.432 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 59.5 pttt -58.62 -36.89 74.78 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.3 t -72.56 -30.42 64.4 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-O 120.924 0.392 . . . . 0.0 110.661 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -71.7 -40.32 69.59 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.262 1.025 . . . . 0.0 110.304 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.486 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 63.4 mtt -56.37 -43.88 79.63 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.234 1.013 . . . . 0.0 110.462 173.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.0 t -64.1 -41.61 97.21 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 124.955 1.409 . . . . 0.0 109.837 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -66.91 -46.01 76.16 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.221 0.608 . . . . 0.0 110.962 -174.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.12 -60.85 2.91 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.699 0.8 . . . . 0.0 111.692 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.2 pt-20 -59.55 -40.6 87.83 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.91 0.757 . . . . 0.0 111.786 -176.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -64.97 -40.26 94.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.8 86.45 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.674 0.789 . . . . 0.0 112.388 -179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.728 ' HG3' HD23 ' A' ' 62' ' ' LEU . 20.0 ptp -110.02 27.95 9.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.439 0.695 . . . . 0.0 112.145 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 34.99 66.9 0.31 Allowed Glycine 0 CA--C 1.54 1.6 0 N-CA-C 116.621 1.409 . . . . 0.0 116.621 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.728 HD23 ' HG3' ' A' ' 60' ' ' MET . 2.0 mm? -89.83 69.57 7.57 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.749 0.785 . . . . 0.0 110.177 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.6 p -100.9 109.19 21.11 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.618 176.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.93 -83.4 0.23 Allowed Glycine 0 C--N 1.341 0.824 0 N-CA-C 110.377 -1.089 . . . . 0.0 110.377 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -82.35 134.21 35.25 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.44 ' HA ' ' HE3' ' A' ' 66' ' ' LYS . 0.8 OUTLIER -105.73 154.28 20.68 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.922 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.413 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.67 155.39 45.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.813 0.845 . . . . 0.0 111.144 -168.387 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.453 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 56.4 m -104.49 169.09 8.67 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.138 0.975 . . . . 0.0 109.885 176.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 18.4 m-85 -130.73 132.19 45.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.266 1.027 . . . . 0.0 109.0 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -127.76 121.87 31.35 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.852 0.861 . . . . 0.0 111.023 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.544 ' HB3' HD21 ' A' ' 76' ' ' LEU . 42.7 t80 -102.43 109.79 21.55 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 52.92 40.9 31.75 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.385 1.074 . . . . 0.0 111.087 -171.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 73.94 4.23 66.53 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 114.838 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 94.4 m -81.24 120.88 25.46 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.77 0.785 . . . . 0.0 109.185 173.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.453 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 3.1 tmtp? -69.42 113.12 6.44 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.544 HD21 ' HB3' ' A' ' 71' ' ' PHE . 33.5 mt -83.64 116.66 22.73 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.8 m -71.66 -27.31 62.98 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.844 0.858 . . . . 0.0 111.4 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 127.97 -44.38 1.24 Allowed Glycine 0 C--N 1.346 1.103 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.376 -177.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -80.47 -1.22 40.75 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -171.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -76.25 148.31 37.7 Favored 'General case' 0 C--N 1.347 0.467 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -102.87 149.86 37.22 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.998 1.319 . . . . 0.0 107.779 174.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 53.5 Cg_endo -66.5 -25.78 47.77 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 121.575 1.517 . . . . 0.0 111.298 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.21 96.99 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.664 0.786 . . . . 0.0 111.133 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.05 -43.48 74.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.761 0.825 . . . . 0.0 111.221 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 76.7 mt -72.17 -19.82 61.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.716 0.806 . . . . 0.0 111.757 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.94 51.24 5.93 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.521 ' SD ' HD13 ' A' ' 28' ' ' LEU . 41.7 ttm -106.36 156.55 18.4 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.831 1.252 . . . . 0.0 109.137 -174.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.9 tt0 -139.47 160.06 40.71 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.004 0.521 . . . . 0.0 110.89 -170.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.7 m -61.85 117.78 6.33 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.232 0.613 . . . . 0.0 110.333 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.15 48.77 4.47 Favored Glycine 0 C--N 1.338 0.676 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.6 t0 -102.87 -160.89 0.81 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.8 tp -142.75 109.79 5.57 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.624 0.726 . . . . 0.0 109.042 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.505 HD11 HD13 ' A' ' 28' ' ' LEU . 45.2 mt -101.0 148.35 7.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 167.448 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -115.56 162.02 17.8 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.668 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 24.6 t -138.41 103.92 2.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -113.02 108.21 17.02 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.238 0.615 . . . . 0.0 110.206 -174.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.957 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 178.603 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.4 m . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -31.54 11.65 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.681 0.792 . . . . 0.0 110.466 -176.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.0 t -91.04 114.56 27.12 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -81.15 70.58 8.01 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -167.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -80.93 -38.91 27.05 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 159.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -128.16 147.42 50.56 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 124.877 1.271 . . . . 0.0 108.947 165.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -117.3 151.84 36.12 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.09 1.356 . . . . 0.0 108.729 -174.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -99.19 103.96 15.88 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.531 HD12 ' HB3' ' A' ' 91' ' ' ASP . 2.2 mm? -100.56 127.91 46.78 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.511 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 93.1 mtt180 -92.5 105.14 17.37 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.164 0.586 . . . . 0.0 110.25 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -99.37 118.24 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.155 -172.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HG2' HG23 ' A' ' 38' ' ' THR . 94.7 mt-30 -125.6 128.26 47.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.013 0.525 . . . . 0.0 110.58 -170.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.686 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -82.02 162.86 42.99 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 123.58 0.55 . . . . 0.0 113.625 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -58.7 -17.08 19.72 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.884 0.874 . . . . 0.0 112.371 168.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.408 ' HB2' ' HB2' ' A' ' 37' ' ' GLN . 43.5 mm-40 -74.48 132.97 42.35 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.188 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -64.45 -34.18 77.6 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -169.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -99.31 16.19 23.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.295 0.638 . . . . 0.0 111.695 178.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HB2' ' HB2' ' A' ' 34' ' ' GLU . 24.1 tp60 -99.26 95.63 7.2 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.117 0.484 . . . . 0.0 110.386 177.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.407 HG23 ' HG2' ' A' ' 31' ' ' GLN . 86.9 m -127.43 129.86 48.26 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 166.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.1 tp -130.64 152.34 50.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.511 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.7 pt-20 -133.04 132.29 41.65 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 164.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -134.25 148.57 29.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 123.779 0.832 . . . . 0.0 109.662 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 m -92.08 109.4 20.76 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.275 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HB3' HD23 ' A' ' 28' ' ' LEU . 56.7 tp -105.75 133.08 51.06 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.925 177.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -77.44 146.64 36.4 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 15.0 ptm180 -66.57 -20.76 66.09 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.324 0.65 . . . . 0.0 112.161 -174.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.75 -18.51 22.84 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.399 1.08 . . . . 0.0 110.899 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.0 m -93.5 126.1 51.43 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 123.712 0.805 . . . . 0.0 109.542 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.48 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 9.9 Cg_endo -65.98 164.41 27.45 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.138 1.892 . . . . 0.0 113.826 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.472 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -59.94 -25.92 65.55 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.106 -177.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 65.0 pttt -57.34 -38.03 73.47 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.3 t -70.45 -31.31 68.42 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 117.819 0.281 . . . . 0.0 110.53 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -69.47 -42.12 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.231 1.012 . . . . 0.0 110.276 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -56.96 -44.89 83.05 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.424 1.089 . . . . 0.0 110.505 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.8 m -67.56 -39.14 84.93 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 113.89 -1.505 . . . . 0.0 110.134 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -65.17 -45.87 83.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.968 0.507 . . . . 0.0 110.164 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -55.9 -60.36 3.58 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.78 1.232 . . . . 0.0 111.722 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.77 -38.09 86.72 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.584 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -65.9 -35.32 80.31 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 121.868 -0.52 . . . . 0.0 111.89 175.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.97 -42.29 99.79 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.461 0.704 . . . . 0.0 112.798 -177.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -106.46 28.64 7.6 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.099 0.56 . . . . 0.0 111.543 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 43.89 38.78 4.67 Favored Glycine 0 N--CA 1.478 1.492 0 N-CA-C 116.355 1.302 . . . . 0.0 116.355 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.4 mt -81.88 67.93 8.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.186 0.994 . . . . 0.0 108.69 175.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.8 m -98.5 128.95 45.06 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.314 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.55 -53.2 2.71 Favored Glycine 0 C--N 1.344 0.975 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -172.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -74.59 93.79 2.56 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 168.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -90.72 141.9 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 166.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.409 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -125.09 160.42 29.11 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.601 1.16 . . . . 0.0 109.638 -173.789 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.446 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.0 m -87.11 159.89 18.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.377 0.671 . . . . 0.0 111.241 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.83 129.14 40.06 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -128.87 143.1 50.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.03 0.932 . . . . 0.0 111.69 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.576 ' HB3' HD21 ' A' ' 76' ' ' LEU . 16.2 t80 -133.67 104.32 6.29 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.914 1.685 . . . . 0.0 107.845 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t70 55.18 30.45 14.54 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 122.519 1.152 . . . . 0.0 111.841 -174.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 88.3 -3.66 85.42 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 114.94 -1.027 . . . . 0.0 113.679 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.0 m -75.54 113.94 13.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.442 0.697 . . . . 0.0 109.596 174.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -66.88 113.59 5.05 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 173.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 71' ' ' PHE . 38.8 mt -78.94 112.19 15.88 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.252 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.0 m -78.95 -26.65 43.56 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.94 0.896 . . . . 0.0 112.672 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.04 -45.73 1.1 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.618 -178.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.16 4.83 44.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 111.431 -164.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.2 pm0 -91.75 147.99 22.58 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.5 mt -98.2 156.21 36.09 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 125.71 1.604 . . . . 0.0 109.108 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.565 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 54.6 Cg_endo -66.76 -23.95 47.79 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 121.546 1.498 . . . . 0.0 111.485 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 -37.52 68.81 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.677 0.791 . . . . 0.0 111.188 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -62.63 -42.47 99.61 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.805 0.842 . . . . 0.0 110.48 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.505 HD21 ' HG3' ' A' ' 80' ' ' GLU . 76.8 mt -79.25 -24.0 43.3 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.81 0.844 . . . . 0.0 111.348 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 73.64 64.8 2.38 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 -175.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 70.2 mtp -106.87 170.85 7.7 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.9 0.88 . . . . 0.0 110.391 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.454 ' H ' ' HB2' ' A' ' 91' ' ' ASP . 39.1 tt0 -126.83 169.51 13.15 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.958 0.903 . . . . 0.0 109.954 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -75.1 11.78 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.787 0.835 . . . . 0.0 112.503 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -148.58 46.77 0.67 Allowed Glycine 0 C--N 1.34 0.797 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.531 ' HB3' HD12 ' A' ' 28' ' ' LEU . 7.2 t70 -93.04 176.64 6.34 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 28.6 tp -131.4 118.88 20.87 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -172.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 44.6 mt -106.63 147.24 12.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 170.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -124.54 155.67 38.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -175.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.686 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 11.6 t -135.12 126.76 46.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 123.343 0.657 . . . . 0.0 109.242 -171.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -130.56 94.74 3.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.246 1.018 . . . . 0.0 109.395 -174.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.127 0 CA-C-O 118.328 -1.262 . . . . 0.0 110.893 176.399 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -140.61 -47.5 0.42 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.246 0.218 . . . . 0.0 110.56 172.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -114.24 79.27 1.24 Allowed 'General case' 0 C--O 1.243 0.73 0 C-N-CA 124.038 0.935 . . . . 0.0 109.136 162.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -100.95 66.28 1.15 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 122.291 1.043 . . . . 0.0 110.914 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -81.72 -39.52 24.11 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 114.086 -1.415 . . . . 0.0 107.219 150.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 11.2 pt20 -130.45 153.07 49.16 Favored 'General case' 0 C--N 1.349 0.555 0 CA-C-N 113.968 -1.469 . . . . 0.0 110.126 -176.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' A' ' 82' ' ' PRO . 57.5 mt -110.59 135.11 51.73 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.778 1.231 . . . . 0.0 108.577 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -90.8 103.84 16.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 35.3 mt -109.65 132.97 53.65 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.185 -0.322 . . . . 0.0 110.329 -171.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -95.2 140.68 29.78 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -129.7 132.37 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -173.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -135.84 141.94 44.74 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.065 0.393 . . . . 0.0 110.866 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.687 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -81.15 172.28 53.96 Favored Glycine 0 C--N 1.347 1.141 0 O-C-N 123.683 0.615 . . . . 0.0 113.306 177.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -41.38 -32.23 0.3 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 124.628 1.171 . . . . 0.0 112.729 165.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.494 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 0.8 OUTLIER -94.79 113.81 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 163.635 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -67.87 -20.26 65.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.087 0.555 . . . . 0.0 112.151 -173.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -63.36 -27.88 69.61 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.825 0.85 . . . . 0.0 110.528 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.494 ' HB2' ' HG2' ' A' ' 34' ' ' GLU . 5.3 tp-100 -76.43 87.75 3.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.6 m -119.02 130.25 55.56 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.094 0.558 . . . . 0.0 110.77 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.57 121.16 18.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.33 1.052 . . . . 0.0 108.204 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -105.11 116.23 31.59 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -123.6 144.95 31.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 123.992 0.917 . . . . 0.0 110.251 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.8 p -91.19 110.02 21.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 44.6 tp -109.59 134.16 52.26 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.735 0.814 . . . . 0.0 108.813 177.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 57.4 m -73.57 142.77 46.62 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 176.11 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.542 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 35.5 ptt180 -62.49 -27.64 69.28 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.2 0.6 . . . . 0.0 112.13 -173.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -95.92 -9.94 30.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.729 0.811 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 44' ' ' SER . 66.4 m -90.13 139.67 27.24 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 123.681 0.793 . . . . 0.0 109.443 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.59 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 7.2 Cg_exo -65.88 157.45 59.06 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.872 2.381 . . . . 0.0 113.093 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.6 mm? -58.11 -27.8 64.06 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.519 173.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.59 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 61.2 pttt -58.09 -38.07 75.7 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.604 0.638 . . . . 0.0 112.608 -177.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.473 HG22 ' O ' ' A' ' 48' ' ' PRO . 13.2 t -72.49 -29.39 63.6 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 120.817 0.341 . . . . 0.0 110.454 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 tt -69.72 -42.52 73.9 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.885 0.874 . . . . 0.0 110.099 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.5 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -56.9 -46.86 81.64 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.344 1.058 . . . . 0.0 110.51 177.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.7 t -64.36 -35.57 81.32 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.404 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -68.7 -46.32 69.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.381 0.672 . . . . 0.0 110.216 -178.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -57.39 -60.15 4.08 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.359 1.064 . . . . 0.0 111.823 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.15 -32.81 73.46 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.84 0.712 . . . . 0.0 111.787 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -73.44 -38.54 65.48 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.23 -50.06 75.45 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.724 0.81 . . . . 0.0 112.669 -175.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.622 ' HG3' HD23 ' A' ' 62' ' ' LEU . 17.9 ptp -100.08 30.51 3.73 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.467 -176.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 46.18 36.63 7.4 Favored Glycine 0 CA--C 1.536 1.363 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.622 HD23 ' HG3' ' A' ' 60' ' ' MET . 3.9 mm? -86.3 9.92 16.38 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.251 0.621 . . . . 0.0 110.571 170.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 p -59.99 102.35 0.16 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.15 0.98 . . . . 0.0 110.262 172.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.37 -57.66 0.71 Allowed Glycine 0 C--N 1.347 1.156 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -88.72 98.49 11.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -85.2 141.83 29.87 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.257 0.48 . . . . 0.0 110.587 -178.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.422 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -127.6 158.88 36.3 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.321 1.048 . . . . 0.0 110.127 -175.298 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.483 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 21.3 m -86.57 162.32 18.07 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.406 0.683 . . . . 0.0 111.243 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -131.22 126.76 36.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.394 1.078 . . . . 0.0 109.152 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.431 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 9.6 m-85 -123.44 151.29 42.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.618 0.767 . . . . 0.0 110.762 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.577 ' HB3' HD21 ' A' ' 76' ' ' LEU . 22.2 t80 -137.25 114.11 10.52 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 172.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.8 25.68 15.21 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.794 0.838 . . . . 0.0 110.824 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 78.03 4.46 86.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.561 -174.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.0 m -82.82 120.2 25.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.785 0.834 . . . . 0.0 109.066 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tmtp? -68.12 115.29 7.44 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.577 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.4 mt -81.97 112.06 18.71 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.0 t -71.87 -34.22 69.03 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.767 0.827 . . . . 0.0 111.979 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.86 -9.43 11.43 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 116.009 -0.541 . . . . 0.0 113.356 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -109.82 10.97 24.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.514 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.4 pm0 -101.74 147.92 25.89 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -98.86 156.26 35.74 Favored Pre-proline 0 C--N 1.312 -1.023 0 C-N-CA 125.183 1.393 . . . . 0.0 108.683 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.542 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 49.4 Cg_endo -65.38 -33.02 49.15 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.799 1.666 . . . . 0.0 111.072 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.16 79.64 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.848 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.49 -42.93 77.95 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.935 0.894 . . . . 0.0 111.683 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.514 HD21 ' HG3' ' A' ' 80' ' ' GLU . 85.0 mt -70.95 -22.98 62.15 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.447 0.699 . . . . 0.0 111.293 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 99.06 17.67 26.79 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.724 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.3 mtt -71.06 166.9 20.41 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.777 0.831 . . . . 0.0 111.627 177.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -166.19 2.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.197 0.999 . . . . 0.0 109.67 175.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.7 m -78.64 12.83 1.87 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -165.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -162.09 63.23 0.27 Allowed Glycine 0 C--N 1.352 1.426 0 CA-C-N 118.245 0.475 . . . . 0.0 112.22 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.44 -168.65 1.72 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.693 0.397 . . . . 0.0 110.038 -170.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.3 tp -139.83 127.5 21.78 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.827 0.851 . . . . 0.0 109.23 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.4 mt -121.2 152.63 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.935 1.294 . . . . 0.0 108.448 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.431 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 30.8 mt-10 -114.04 160.73 18.56 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.793 1.237 . . . . 0.0 107.899 -173.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.687 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 9.4 t -137.26 107.88 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.85 0.86 . . . . 0.0 109.034 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -105.29 94.76 5.4 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.218 1.007 . . . . 0.0 108.656 -176.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.464 0 CA-C-O 118.547 -1.141 . . . . 0.0 111.773 -178.035 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -99.5 -43.57 6.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.23 0.612 . . . . 0.0 110.908 -175.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.9 t -110.48 92.43 4.04 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-O 121.824 0.821 . . . . 0.0 110.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -101.85 70.25 1.23 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.409 0.684 . . . . 0.0 109.786 170.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -74.6 -60.24 2.37 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 170.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.516 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 4.3 pp0? -119.97 142.7 48.53 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 167.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.405 HD22 ' HB2' ' A' ' 82' ' ' PRO . 6.6 mp -102.73 125.21 49.38 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.149 1.38 . . . . 0.0 109.437 -166.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -80.07 100.53 8.24 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 176.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.7 mt -114.13 128.86 56.57 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.767 0.427 . . . . 0.0 110.049 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -95.33 132.05 40.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -123.17 129.42 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -174.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 37' ' ' GLN . 28.6 mt-30 -129.55 130.59 45.95 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -175.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.613 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -82.31 -173.8 49.26 Favored Glycine 0 C--N 1.346 1.11 0 O-C-N 123.368 0.417 . . . . 0.0 113.335 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -30.96 -45.9 0.08 Allowed 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 124.947 1.299 . . . . 0.0 112.392 161.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.95 113.33 21.32 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 167.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -70.2 -19.78 63.15 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.475 0.31 . . . . 0.0 110.555 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.04 -33.32 75.49 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 124.06 0.944 . . . . 0.0 110.371 170.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 31' ' ' GLN . 30.3 tp60 -68.71 87.33 0.34 Allowed 'General case' 0 C--N 1.352 0.68 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 172.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m -109.44 112.75 25.04 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -128.0 113.53 15.95 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 -170.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -106.74 121.98 45.45 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -172.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -132.01 147.11 32.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.854 0.862 . . . . 0.0 110.832 -171.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.8 m -90.9 111.62 23.13 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.248 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.492 HD21 HD22 ' A' ' 49' ' ' LEU . 29.2 tp -114.62 121.24 42.81 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.254 0.621 . . . . 0.0 109.523 175.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 21.3 m -75.16 149.13 39.09 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.559 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 30.6 ptt180 -69.94 -13.47 62.26 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -99.42 -19.62 16.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.498 0.719 . . . . 0.0 109.665 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.44 ' HB3' HG21 ' A' ' 51' ' ' THR . 58.0 m -85.54 133.4 42.15 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.197 0.999 . . . . 0.0 109.597 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.467 ' O ' HG22 ' A' ' 51' ' ' THR . 3.3 Cg_exo -71.77 159.42 50.75 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.492 HD22 HD21 ' A' ' 43' ' ' LEU . 2.7 mm? -53.85 -30.69 46.66 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.06 1.344 . . . . 0.0 111.774 177.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -39.76 58.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.007 0.923 . . . . 0.0 112.935 177.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.467 HG22 ' O ' ' A' ' 48' ' ' PRO . 2.5 t -69.72 -33.12 72.04 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 120.87 0.367 . . . . 0.0 110.888 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.85 -38.68 73.17 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.254 1.021 . . . . 0.0 110.455 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.482 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -59.01 -42.77 90.93 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.818 0.847 . . . . 0.0 110.192 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -61.62 -42.51 98.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.709 1.256 . . . . 0.0 110.827 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -68.96 -44.73 72.37 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.316 0.647 . . . . 0.0 110.922 -174.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -58.13 -54.05 51.35 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.304 1.042 . . . . 0.0 111.61 176.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.59 -41.62 96.13 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.593 0.558 . . . . 0.0 110.641 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -57.56 -44.37 85.21 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.765 0.426 . . . . 0.0 111.657 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -57.17 7.33 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -103.52 33.06 3.51 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 117.791 0.269 . . . . 0.0 111.555 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.62 49.7 26.73 Favored Glycine 0 CA--C 1.537 1.447 0 N-CA-C 116.59 1.396 . . . . 0.0 116.59 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -90.88 20.15 5.03 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.024 0.929 . . . . 0.0 111.06 169.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.4 p -68.07 85.1 0.24 Allowed 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.628 0.771 . . . . 0.0 110.401 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.61 -41.32 1.24 Allowed Glycine 0 C--N 1.346 1.124 0 C-N-CA 124.043 0.83 . . . . 0.0 111.17 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -100.65 103.26 14.53 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.893 0.877 . . . . 0.0 109.025 175.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -87.55 143.12 27.36 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 120.849 0.357 . . . . 0.0 110.752 -178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.483 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.19 153.29 47.06 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.408 1.083 . . . . 0.0 109.951 -175.216 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.1 m -83.22 156.79 22.98 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.85 0.86 . . . . 0.0 111.209 -176.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 36.1 m-85 -125.51 128.95 48.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.678 1.191 . . . . 0.0 108.84 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -131.35 139.41 49.51 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.65 0.78 . . . . 0.0 111.033 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -131.59 111.72 11.97 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.429 1.492 . . . . 0.0 108.266 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 53.88 30.36 11.39 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.801 1.241 . . . . 0.0 112.044 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 92.07 -19.01 51.96 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.712 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.2 m -70.79 137.69 49.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.932 0.893 . . . . 0.0 110.665 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -89.41 117.24 28.19 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.41 109.34 13.68 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -79.24 -28.83 42.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.641 0.776 . . . . 0.0 111.457 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.65 -52.04 0.66 Allowed Glycine 0 C--N 1.348 1.201 0 C-N-CA 122.994 0.33 . . . . 0.0 113.327 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.0 mtp-105 -85.6 2.12 46.35 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.916 0.886 . . . . 0.0 113.315 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.556 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.1 pm0 -85.71 148.82 25.69 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 38.5 mt -100.4 151.35 37.53 Favored Pre-proline 0 C--N 1.316 -0.885 0 C-N-CA 124.957 1.303 . . . . 0.0 108.614 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.559 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 57.5 Cg_endo -65.51 -35.05 40.42 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 121.966 1.777 . . . . 0.0 111.232 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . . . -60.26 -33.84 72.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.971 0.909 . . . . 0.0 111.151 173.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -73.8 -44.67 55.17 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.539 0.735 . . . . 0.0 110.72 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.556 HD21 ' HG3' ' A' ' 80' ' ' GLU . 26.5 mt -66.9 -24.53 66.12 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.217 0.607 . . . . 0.0 110.817 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 88.77 51.79 2.96 Favored Glycine 0 C--N 1.345 1.079 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -175.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.2 mtp -112.82 165.33 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.408 1.083 . . . . 0.0 109.946 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.403 ' HG2' ' N ' ' A' ' 89' ' ' SER . 31.1 tt0 -153.6 166.45 32.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.142 0.977 . . . . 0.0 108.839 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.403 ' N ' ' HG2' ' A' ' 88' ' ' GLU . 33.3 m -54.59 111.8 0.88 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.568 0.747 . . . . 0.0 110.052 173.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.98 -28.79 3.3 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.045 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.48 168.21 1.66 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.8 tp -130.26 109.04 10.47 Favored 'General case' 0 C--N 1.349 0.555 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -168.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.7 mt -92.06 152.2 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 171.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -124.06 165.16 17.97 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 -178.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.613 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 14.8 t -137.06 133.61 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -137.48 131.79 32.36 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.319 1.048 . . . . 0.0 108.745 -170.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.15 0 CA-C-O 118.795 -1.003 . . . . 0.0 112.37 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 p . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -99.48 -45.67 5.74 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.425 0.69 . . . . 0.0 109.82 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.1 t -101.05 79.58 2.03 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.47 1.128 . . . . 0.0 108.615 175.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.405 ' O ' ' HD3' ' A' ' 45' ' ' ARG . 32.4 m -87.21 130.62 34.49 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.341 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -59.95 -48.67 80.74 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.512 0.725 . . . . 0.0 109.24 173.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.577 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 3.2 pp0? -126.46 144.99 50.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.803 173.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -116.06 150.41 37.34 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.03 1.332 . . . . 0.0 107.504 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -99.82 103.32 14.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.568 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.8 mm? -101.16 126.97 47.91 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -91.48 105.28 17.65 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.387 0.675 . . . . 0.0 109.768 -176.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.33 123.82 52.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.041 0.937 . . . . 0.0 108.695 -173.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -130.69 138.19 49.91 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.816 0.446 . . . . 0.0 110.491 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.645 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -75.75 174.12 52.95 Favored Glycine 0 C--N 1.347 1.154 0 O-C-N 123.684 0.615 . . . . 0.0 113.185 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -45.61 -33.28 2.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.132 0.573 . . . . 0.0 111.153 164.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -77.78 110.33 12.56 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.67 -25.15 63.76 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -170.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -85.74 -9.87 56.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.888 0.475 . . . . 0.0 111.314 175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -77.29 87.71 3.71 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 167.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.4 m -122.66 132.68 54.38 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.167 0.987 . . . . 0.0 109.493 -172.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.5 tp -131.97 154.35 49.4 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 173.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.1 132.53 44.91 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 167.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -131.0 146.39 34.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 123.613 0.765 . . . . 0.0 109.521 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.3 p -90.86 105.94 18.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.568 ' HB3' HD23 ' A' ' 28' ' ' LEU . 66.6 tp -107.34 130.72 54.75 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.919 176.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.577 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 41.9 t -75.62 152.32 37.65 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.654 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 31.6 ptt180 -69.13 -13.38 62.39 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.479 0.712 . . . . 0.0 111.746 179.342 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -99.13 -23.67 15.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.919 0.888 . . . . 0.0 109.882 177.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 133.04 50.88 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.63 0.772 . . . . 0.0 110.305 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.48 ' O ' HG22 ' A' ' 51' ' ' THR . 6.1 Cg_exo -69.64 158.6 56.54 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.833 2.355 . . . . 0.0 113.271 178.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.3 mm? -58.35 -25.79 62.38 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.742 1.217 . . . . 0.0 112.04 177.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.51 -39.16 75.9 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.223 0.609 . . . . 0.0 112.387 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -72.38 -29.53 63.85 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 120.897 0.38 . . . . 0.0 110.778 -178.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -70.39 -41.45 72.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.037 0.935 . . . . 0.0 110.314 172.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 63.8 mtt -55.02 -49.72 70.85 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.994 0.918 . . . . 0.0 110.835 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 p -67.06 -38.35 85.65 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.972 1.42 . . . . 0.0 109.627 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -64.64 -48.79 73.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.024 0.53 . . . . 0.0 110.288 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -56.29 -59.08 5.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.088 0.955 . . . . 0.0 111.837 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.558 ' HA ' HD23 ' A' ' 62' ' ' LEU . 15.8 pt-20 -62.31 -31.64 72.28 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.027 0.83 . . . . 0.0 112.55 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -70.72 -46.42 63.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.434 0.294 . . . . 0.0 111.789 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.21 -50.6 45.86 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.55 0.74 . . . . 0.0 112.451 -173.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 59.2 tpp -85.97 25.45 1.13 Allowed 'General case' 0 CA--C 1.572 1.825 0 C-N-CA 124.472 1.109 . . . . 0.0 111.322 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.56 47.88 29.06 Favored Glycine 0 C--N 1.356 1.641 0 N-CA-C 116.633 1.413 . . . . 0.0 116.633 177.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.558 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.9 mm? -83.14 15.53 2.81 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 117.416 0.608 . . . . 0.0 112.455 179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -62.7 91.35 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.489 0.716 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.08 -42.35 0.56 Allowed Glycine 0 C--N 1.347 1.16 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.382 -176.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -124.96 134.22 52.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.87 0.868 . . . . 0.0 109.527 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -100.79 134.94 43.01 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 168.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.547 HD11 ' HG ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -123.17 159.82 27.81 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.945 0.898 . . . . 0.0 111.038 -164.989 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 160.27 14.76 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.289 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -124.68 131.79 53.44 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.011 0.924 . . . . 0.0 109.37 -177.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -134.06 116.92 16.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.388 1.075 . . . . 0.0 110.534 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.428 ' HB3' HD11 ' A' ' 76' ' ' LEU . 2.3 t80 -97.41 109.76 22.45 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.6 t70 51.8 40.57 28.01 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.052 0.93 . . . . 0.0 111.02 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 72.71 6.27 66.42 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 114.982 -1.008 . . . . 0.0 114.575 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -87.84 116.99 26.38 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.97 0.908 . . . . 0.0 109.57 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -67.16 113.84 5.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.425 0.453 . . . . 0.0 110.232 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.428 HD11 ' HB3' ' A' ' 71' ' ' PHE . 1.1 mm? -80.65 123.69 28.37 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.7 m -75.09 -30.12 60.82 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.768 0.827 . . . . 0.0 110.716 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.91 -38.32 2.27 Favored Glycine 0 C--N 1.345 1.034 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.219 -175.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -87.55 2.56 50.44 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -170.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -89.54 147.71 23.8 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 172.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.2 mt -97.21 158.08 33.84 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 125.119 1.368 . . . . 0.0 108.261 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.654 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 62.0 Cg_endo -66.29 -27.56 47.95 Favored 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 110.781 176.018 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.69 -37.12 81.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.594 0.757 . . . . 0.0 110.707 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -68.65 -41.33 79.5 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.789 0.835 . . . . 0.0 110.647 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.536 HD21 ' HG3' ' A' ' 80' ' ' GLU . 84.5 mt -75.54 -24.12 56.7 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.074 0.95 . . . . 0.0 112.17 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.99 58.56 3.18 Favored Glycine 0 C--N 1.346 1.091 0 O-C-N 123.371 0.419 . . . . 0.0 112.22 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.8 mtp -102.83 171.0 7.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.115 0.966 . . . . 0.0 110.079 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.4 tt0 -137.23 157.57 46.35 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.068 0.547 . . . . 0.0 110.876 -178.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.3 p -59.28 111.1 1.23 Allowed 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 168.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 94.8 42.23 3.9 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.889 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.536 ' HB3' HD12 ' A' ' 28' ' ' LEU . 2.4 t70 -97.53 -171.57 2.22 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 177.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 35.7 tp -137.03 135.48 37.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.261 0.625 . . . . 0.0 109.5 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.4 mt -127.34 148.92 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.66 154.36 39.48 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -173.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.645 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.8 t -133.7 121.93 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -125.91 96.77 4.87 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.407 1.083 . . . . 0.0 109.566 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.218 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.352 -179.027 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.575 ' N ' HE22 ' A' ' 25' ' ' GLN . 20.1 p . . . . . 0 N--CA 1.478 0.944 0 CA-C-O 120.782 0.325 . . . . 0.0 110.897 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.32 -46.67 5.19 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 168.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -112.56 105.76 14.04 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 105.761 -1.941 . . . . 0.0 105.761 158.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 t -85.5 67.24 10.04 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.549 0.69 . . . . 0.0 111.147 -170.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -83.34 -39.46 20.7 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 152.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.575 HE22 ' N ' ' A' ' 20' ' ' THR . 4.3 pp0? -91.44 153.68 19.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.563 -177.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -116.77 151.01 37.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.698 1.599 . . . . 0.0 109.323 -177.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -103.06 109.78 21.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 171.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.513 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.1 mm? -112.24 139.63 47.62 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.3 mtp85 -92.76 112.83 24.93 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.493 0.717 . . . . 0.0 110.546 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.28 113.5 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.499 1.12 . . . . 0.0 108.665 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -126.29 133.59 51.37 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -172.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.578 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -84.07 169.91 46.68 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.718 0.636 . . . . 0.0 112.556 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -55.32 -15.6 2.66 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 173.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -86.96 140.06 29.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.248 0.619 . . . . 0.0 109.547 172.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -65.1 -35.2 80.37 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.319 0.648 . . . . 0.0 110.996 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -67.48 -36.95 82.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.316 0.647 . . . . 0.0 110.511 177.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -74.87 85.87 2.23 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.445 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.3 m -123.12 126.79 47.7 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.274 1.03 . . . . 0.0 108.411 172.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -139.85 142.38 36.59 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -133.71 136.61 44.77 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -140.2 151.71 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 123.919 0.887 . . . . 0.0 109.989 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -92.13 108.67 20.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.424 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.513 ' HB3' HD23 ' A' ' 28' ' ' LEU . 31.2 tp -105.21 131.47 52.64 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.531 1.132 . . . . 0.0 109.178 175.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 44.7 m -76.84 151.65 35.79 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.514 0.509 . . . . 0.0 109.654 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.595 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 12.8 ptm180 -67.53 -18.69 65.12 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.257 0.551 . . . . 0.0 110.949 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -92.92 -30.93 15.14 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.138 1.375 . . . . 0.0 109.77 -175.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.414 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 50.6 m -88.34 140.63 30.34 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.21 1.004 . . . . 0.0 110.35 -176.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.506 ' O ' HG22 ' A' ' 51' ' ' THR . 6.8 Cg_exo -67.78 157.66 60.76 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.221 2.614 . . . . 0.0 113.408 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -51.79 -32.35 30.88 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.061 1.344 . . . . 0.0 112.068 173.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.466 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -58.88 -35.88 73.72 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.638 0.775 . . . . 0.0 112.593 -177.351 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.506 HG22 ' O ' ' A' ' 48' ' ' PRO . 4.3 t -67.7 -33.69 75.39 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.93 -40.78 68.52 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.532 1.133 . . . . 0.0 110.607 175.193 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.9 mtt -58.83 -46.33 87.92 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.072 0.949 . . . . 0.0 110.865 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 p -68.18 -28.06 66.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.48 1.112 . . . . 0.0 110.799 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -71.31 -47.7 55.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.323 0.649 . . . . 0.0 110.322 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.26 -58.83 5.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.38 1.072 . . . . 0.0 111.905 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.53 ' HA ' HD23 ' A' ' 62' ' ' LEU . 6.7 pt-20 -59.52 -31.04 69.02 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 124.018 0.823 . . . . 0.0 112.427 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.47 -43.06 70.56 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.61 -54.68 29.81 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -174.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.5 mpp? -106.86 34.58 3.37 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 122.392 0.277 . . . . 0.0 111.494 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 46.09 48.41 14.74 Favored Glycine 0 N--CA 1.474 1.184 0 N-CA-C 116.92 1.528 . . . . 0.0 116.92 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.53 HD23 ' HA ' ' A' ' 57' ' ' GLU . 2.5 mm? -81.74 21.6 0.82 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.37 0.668 . . . . 0.0 112.407 177.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.9 p -70.28 123.75 22.46 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.301 0.64 . . . . 0.0 110.766 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 130.38 -77.96 0.39 Allowed Glycine 0 C--N 1.35 1.322 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -87.46 116.05 25.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 171.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -80.25 150.14 30.14 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.466 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -127.67 149.98 49.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.296 1.038 . . . . 0.0 109.7 -177.409 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -93.3 158.69 15.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.424 0.69 . . . . 0.0 110.732 -175.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 48.1 m-85 -124.32 127.83 48.21 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.432 1.093 . . . . 0.0 109.375 -176.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.25 129.76 49.57 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.082 0.953 . . . . 0.0 110.195 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.494 ' HB3' HD21 ' A' ' 76' ' ' LEU . 51.6 t80 -108.02 109.41 20.86 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.77 27.08 16.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.557 1.143 . . . . 0.0 111.391 -172.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.55 -2.11 88.26 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.055 -0.521 . . . . 0.0 113.852 -175.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.8 m -79.01 122.56 26.34 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -67.87 117.64 10.02 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 71' ' ' PHE . 21.5 mt -92.29 120.34 32.74 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.2 t -77.47 -23.02 50.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.264 0.626 . . . . 0.0 110.965 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.99 -38.64 2.99 Favored Glycine 0 C--N 1.344 0.991 0 C-N-CA 123.043 0.354 . . . . 0.0 113.286 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.7 mtp180 -76.41 -14.98 60.04 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.558 0.743 . . . . 0.0 112.849 -171.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.24 149.02 44.94 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 173.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 48' ' ' PRO . 21.8 mt -99.13 157.21 34.46 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 125.161 1.384 . . . . 0.0 107.302 176.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.595 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.1 Cg_endo -65.54 -17.02 56.3 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 121.466 1.444 . . . . 0.0 111.39 178.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.78 93.38 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.747 0.819 . . . . 0.0 111.006 170.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -68.01 -45.62 73.54 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.107 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.514 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 79.5 mt -74.24 -15.0 61.01 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.616 0.766 . . . . 0.0 112.561 -176.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.67 35.73 27.86 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.153 0.283 . . . . 0.0 112.991 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.514 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 60.5 mtp -90.22 166.4 13.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.169 0.988 . . . . 0.0 110.855 -177.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -153.81 166.38 33.07 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.3 t -61.51 112.05 2.05 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.888 0.475 . . . . 0.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 130.5 -27.63 3.92 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.814 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.451 ' HB2' HD12 ' A' ' 28' ' ' LEU . 1.8 m-20 -58.08 172.72 0.4 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.2 tp -133.83 113.94 12.8 Favored 'General case' 0 C--N 1.352 0.682 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.393 -163.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.411 HD11 ' HE1' ' A' ' 87' ' ' MET . 39.4 mt -100.39 149.17 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 172.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 69' ' ' PHE . 36.5 mt-10 -112.96 158.38 20.31 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -172.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.578 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.1 t -135.15 118.73 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -111.31 106.17 15.04 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.277 1.431 . . . . 0.0 109.033 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.447 0 CA-C-O 118.55 -1.139 . . . . 0.0 111.572 179.263 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 CA--C 1.55 0.973 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -141.16 -49.25 0.41 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 118.458 0.572 . . . . 0.0 111.312 172.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.4 p -113.36 81.23 1.47 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.329 0.652 . . . . 0.0 112.446 -177.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 p -100.96 66.18 1.14 Allowed 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.504 1.145 . . . . 0.0 108.792 166.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.659 ' HG3' ' HG2' ' A' ' 25' ' ' GLN . 7.6 pt20 -84.55 -49.48 8.56 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 113.799 -1.546 . . . . 0.0 109.986 164.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.659 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 4.8 mm-40 -103.53 156.68 17.59 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.224 1.01 . . . . 0.0 110.692 -171.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 82.8 mt -91.55 129.67 37.5 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.587 -174.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -89.17 102.73 15.38 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.636 HD23 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mm? -106.19 122.02 45.35 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -89.79 124.36 34.59 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.328 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.83 117.17 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.223 1.009 . . . . 0.0 109.54 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -127.01 130.92 50.96 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.965 0.906 . . . . 0.0 108.579 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.485 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -93.11 170.31 31.56 Favored Glycine 0 C--N 1.339 0.698 0 O-C-N 123.753 0.658 . . . . 0.0 113.596 -173.3 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.0 ptmm? -58.15 -12.48 3.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.91 0.884 . . . . 0.0 112.007 163.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -77.19 107.66 9.73 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 105.478 -2.045 . . . . 0.0 105.478 164.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -63.99 -19.92 65.51 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -165.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -99.76 -8.1 24.67 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.929 0.492 . . . . 0.0 111.714 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -69.6 88.85 0.52 Allowed 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.158 0.583 . . . . 0.0 110.345 178.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -106.41 107.84 19.05 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 171.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -131.2 137.47 48.97 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -132.01 141.57 49.3 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.056 0.455 . . . . 0.0 109.878 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.33 152.6 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.119 0.968 . . . . 0.0 109.84 178.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -91.71 110.78 22.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.636 ' HB3' HD23 ' A' ' 28' ' ' LEU . 32.2 tp -102.85 136.66 42.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.465 0.706 . . . . 0.0 109.824 176.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 34.0 t -76.29 143.88 40.62 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.582 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.1 ptm180 -60.58 -29.41 69.17 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.986 0.914 . . . . 0.0 112.835 -175.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -110.57 3.06 19.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.532 0.733 . . . . 0.0 111.977 -178.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 70.1 m -93.47 134.04 27.33 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 170.385 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.567 ' O ' HG22 ' A' ' 51' ' ' THR . 2.8 Cg_exo -65.95 155.69 68.21 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.753 2.302 . . . . 0.0 112.784 -176.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -53.54 -27.53 26.54 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.982 1.313 . . . . 0.0 112.322 176.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.69 -37.98 74.39 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.759 0.824 . . . . 0.0 112.949 179.555 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.3 t -67.3 -33.31 75.02 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.348 0.594 . . . . 0.0 110.359 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.36 -41.06 66.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.961 1.304 . . . . 0.0 110.442 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.2 mtt -55.05 -44.03 74.34 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.93 0.892 . . . . 0.0 110.915 176.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -67.26 -35.38 79.39 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -71.53 -46.76 58.7 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.909 0.484 . . . . 0.0 110.777 -175.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -54.09 -57.46 11.0 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.811 0.845 . . . . 0.0 111.743 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.49 ' HA ' HD23 ' A' ' 62' ' ' LEU . 7.7 pt-20 -60.1 -31.83 70.41 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.894 0.746 . . . . 0.0 111.768 -177.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.51 -36.75 76.75 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 173.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.87 -52.87 59.08 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -106.39 27.24 8.93 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.446 0.298 . . . . 0.0 110.941 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 40.12 53.65 3.25 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 116.46 1.344 . . . . 0.0 116.46 -179.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.6 mm? -68.45 70.9 0.18 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.679 1.192 . . . . 0.0 112.367 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.3 m -101.47 116.36 32.59 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.09 0.956 . . . . 0.0 108.771 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 115.28 -78.58 0.27 Allowed Glycine 0 C--N 1.346 1.111 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -70.45 104.92 2.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 171.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -101.11 148.34 25.18 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.517 HD23 ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -126.75 157.66 38.56 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.659 0.784 . . . . 0.0 111.728 -166.328 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 31.8 m -113.32 156.57 23.14 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.306 1.042 . . . . 0.0 109.803 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.517 ' CE1' HD23 ' A' ' 67' ' ' LEU . 38.9 m-85 -122.61 128.2 50.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.659 0.784 . . . . 0.0 110.041 -172.1 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 60.7 m-85 -127.44 139.32 52.9 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.868 0.867 . . . . 0.0 110.783 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -116.24 107.08 14.41 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 51.19 41.42 27.73 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 122.093 0.949 . . . . 0.0 111.244 -172.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.55 -8.22 66.02 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 115.032 -0.985 . . . . 0.0 114.949 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.8 m -74.51 115.58 14.21 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.225 0.61 . . . . 0.0 109.719 178.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.48 114.06 4.59 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.01 109.12 16.06 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.6 m -69.48 -28.11 65.79 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.089 0.955 . . . . 0.0 111.005 -176.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.52 -49.5 0.9 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.385 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -87.42 10.83 16.22 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.628 0.771 . . . . 0.0 112.967 -170.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 mp0 -83.87 148.13 27.14 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 173.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 30.3 mt -101.26 152.05 37.86 Favored Pre-proline 0 C--N 1.309 -1.182 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 176.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.582 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 59.1 Cg_endo -64.36 -35.66 49.14 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.687 1.591 . . . . 0.0 110.989 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.52 -30.55 70.25 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.164 0.586 . . . . 0.0 110.8 175.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -71.87 -45.16 62.31 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.805 0.842 . . . . 0.0 111.592 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.425 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 54.6 mt -69.91 -24.94 63.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.49 0.716 . . . . 0.0 111.487 -176.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.0 45.92 3.48 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 -173.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.425 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 63.3 mtp -104.76 163.97 12.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.158 0.983 . . . . 0.0 108.99 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.415 ' HG2' ' H ' ' A' ' 89' ' ' SER . 38.4 tt0 -135.07 178.37 7.08 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 -176.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.415 ' H ' ' HG2' ' A' ' 88' ' ' GLU . 30.0 p -74.19 19.22 0.13 Allowed 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -176.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.09 61.14 0.3 Allowed Glycine 0 C--N 1.344 0.985 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 172.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.485 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -111.12 -177.49 3.22 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.568 0.747 . . . . 0.0 109.399 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 37.6 tp -137.52 114.78 10.94 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 109.913 -167.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 43.1 mt -98.11 150.91 4.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 113.956 -1.474 . . . . 0.0 108.563 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 41.9 mt-10 -106.14 152.86 22.89 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 -175.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.485 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.6 t -130.63 109.44 16.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -115.93 96.36 5.55 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.156 0.982 . . . . 0.0 109.835 -174.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.256 0 CA-C-O 118.855 -0.97 . . . . 0.0 111.708 177.259 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.1 m . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.68 -176.0 4.14 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.226 1.01 . . . . 0.0 111.746 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.6 p -60.99 101.79 0.17 Allowed 'General case' 0 C--N 1.354 0.771 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 165.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 99.49 3.61 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.975 -170.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.483 ' HG2' ' HG3' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -67.67 -27.95 67.28 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.275 0.63 . . . . 0.0 110.145 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 40.4 mt-30 -126.74 143.01 51.37 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 170.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 82' ' ' PRO . 56.2 mt -107.84 129.27 55.08 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.187 1.395 . . . . 0.0 109.173 -177.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -84.25 103.12 13.18 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -112.27 132.49 54.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.034 0.534 . . . . 0.0 110.336 -175.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -91.2 110.59 21.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.169 0.987 . . . . 0.0 109.021 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HE2' ' A' ' 69' ' ' PHE . 2.2 t -105.78 124.72 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -177.284 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -135.5 145.14 46.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 118.099 0.409 . . . . 0.0 110.359 -173.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.557 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -83.54 176.01 52.41 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.374 0.421 . . . . 0.0 112.538 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -42.54 -27.33 0.16 Allowed 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.332 1.053 . . . . 0.0 113.428 166.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -104.22 123.59 47.6 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 165.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -71.75 -11.04 60.63 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.178 0.591 . . . . 0.0 111.624 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -62.53 -40.99 98.53 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.299 0.64 . . . . 0.0 109.552 169.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -75.18 90.41 2.55 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.275 172.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 m -121.76 140.66 52.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.901 0.88 . . . . 0.0 110.192 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 56' ' ' TYR . 15.2 tp -138.3 127.39 24.16 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 167.149 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -103.17 113.03 26.18 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 175.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.95 151.17 23.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 123.828 0.851 . . . . 0.0 110.435 -172.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -92.49 109.23 20.62 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 171.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.433 ' HB2' HD12 ' A' ' 52' ' ' LEU . 23.6 tp -105.82 125.53 51.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.25 0.62 . . . . 0.0 109.381 172.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 58.6 m -73.18 144.34 46.87 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.525 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 26.4 ptt180 -62.54 -26.51 68.61 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.876 0.87 . . . . 0.0 112.398 -173.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -99.56 -11.7 20.78 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.783 0.833 . . . . 0.0 111.029 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 50.4 m -92.34 136.77 25.19 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 123.743 0.817 . . . . 0.0 109.381 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.551 ' O ' HG22 ' A' ' 51' ' ' THR . 3.7 Cg_exo -71.41 161.69 44.75 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.796 2.331 . . . . 0.0 113.781 -176.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.558 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.8 mm? -53.83 -31.4 49.14 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 125.241 1.416 . . . . 0.0 112.242 175.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -32.71 72.42 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.551 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -70.18 -33.26 71.51 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 118.113 0.415 . . . . 0.0 111.036 174.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.433 HD12 ' HB2' ' A' ' 43' ' ' LEU . 6.3 tt -68.94 -39.31 79.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.1 0.96 . . . . 0.0 110.126 173.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.3 mtt -59.01 -42.73 90.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.327 1.051 . . . . 0.0 110.09 175.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 t -68.02 -40.28 82.97 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.259 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -66.63 -48.2 70.2 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 120.952 0.406 . . . . 0.0 110.569 -174.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.417 ' HA ' HD22 ' A' ' 39' ' ' LEU . 50.4 t80 -55.18 -53.46 55.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.005 1.322 . . . . 0.0 112.213 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.83 -46.62 84.26 Favored 'General case' 0 CA--C 1.558 1.253 0 O-C-N 124.154 0.908 . . . . 0.0 110.908 -179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.38 -45.54 84.36 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.241 0.616 . . . . 0.0 111.994 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.77 83.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.074 0.95 . . . . 0.0 112.935 -178.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.2 mtm -102.34 33.54 3.09 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.084 0.554 . . . . 0.0 111.827 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.36 35.37 14.95 Favored Glycine 0 CA--C 1.537 1.425 0 N-CA-C 117.492 1.757 . . . . 0.0 117.492 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -94.3 42.01 1.09 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.02 0.928 . . . . 0.0 108.75 167.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.9 m -67.67 112.33 4.72 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.066 0.946 . . . . 0.0 111.458 -175.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 19.28 65.79 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.204 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -139.91 78.01 1.64 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.826 1.25 . . . . 0.0 107.794 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.419 ' HD2' ' HB3' ' A' ' 53' ' ' MET . 7.2 ttpm? -80.07 135.63 36.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.654 0.74 . . . . 0.0 110.54 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.415 HD13 ' N ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -98.19 160.29 14.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.38 1.472 . . . . 0.0 108.213 177.261 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.593 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 21.1 m -76.95 144.46 38.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.407 0.283 . . . . 0.0 110.892 -174.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.451 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 49.2 m-85 -120.26 125.85 49.13 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.894 0.877 . . . . 0.0 109.892 179.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -125.13 133.08 52.97 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.266 1.026 . . . . 0.0 110.094 177.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.447 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.1 t80 -124.46 114.56 19.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.219 1.008 . . . . 0.0 108.538 174.403 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.14 27.83 15.58 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.593 1.157 . . . . 0.0 111.368 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.84 -8.17 76.98 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.314 -0.857 . . . . 0.0 113.828 -177.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 96.7 m -73.76 119.86 18.56 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.114 0.566 . . . . 0.0 110.272 176.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -68.07 113.5 5.79 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.447 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.3 mt -82.03 116.84 21.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.7 m -73.37 -31.65 64.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.656 0.782 . . . . 0.0 111.155 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.8 -48.65 0.96 Allowed Glycine 0 C--N 1.343 0.923 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.296 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.5 mtp85 -86.45 9.72 17.34 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -169.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -84.66 147.54 26.89 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 166.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.16 161.96 26.41 Favored Pre-proline 0 C--N 1.313 -0.981 0 C-N-CA 124.541 1.136 . . . . 0.0 108.566 174.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.525 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 60.8 Cg_endo -66.23 -30.29 46.07 Favored 'Trans proline' 0 C--N 1.368 1.581 0 C-N-CA 121.429 1.419 . . . . 0.0 110.812 174.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.4 80.12 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.053 0.941 . . . . 0.0 111.032 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -69.54 -48.78 59.25 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.016 0.927 . . . . 0.0 111.841 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.426 HD12 ' HE2' ' A' ' 87' ' ' MET . 87.9 mt -71.83 -20.8 61.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.433 0.693 . . . . 0.0 111.397 -177.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.92 15.66 51.29 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.455 0.472 . . . . 0.0 112.456 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.558 ' HE1' HD11 ' A' ' 49' ' ' LEU . 57.9 mtm -76.54 160.09 29.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.326 0.65 . . . . 0.0 110.869 177.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -160.82 166.64 28.24 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.712 1.205 . . . . 0.0 107.981 -170.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.1 m -61.04 106.08 0.55 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 118.029 0.377 . . . . 0.0 110.519 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 136.56 -32.73 2.43 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.032 -0.531 . . . . 0.0 113.219 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.7 170.81 0.07 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.4 tp -132.16 109.28 9.85 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -168.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 51.6 mt -95.94 147.96 5.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.567 -1.272 . . . . 0.0 107.567 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -124.06 161.76 24.89 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -172.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.557 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.7 t -140.06 128.04 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.844 0.858 . . . . 0.0 110.418 -169.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.593 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 55.9 m95 -106.11 97.88 7.64 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 171.028 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -175.349 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.04 -45.18 61.79 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -138.67 120.84 15.76 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.788 176.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -84.57 101.08 11.83 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -70.21 -29.75 66.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 121.592 0.711 . . . . 0.0 109.334 174.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.15 139.88 37.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.524 1.13 . . . . 0.0 108.69 166.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.5 mp -110.23 147.95 32.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.23 1.412 . . . . 0.0 108.431 -172.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -102.14 104.73 15.35 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.547 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.9 mm? -104.65 135.85 45.28 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -175.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -90.59 128.94 36.75 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.94 123.21 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -172.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -134.01 141.06 47.09 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.016 0.371 . . . . 0.0 110.564 -173.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.666 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -76.47 175.37 53.1 Favored Glycine 0 C--N 1.342 0.894 0 O-C-N 123.871 0.732 . . . . 0.0 112.323 177.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -39.52 -37.35 0.47 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.719 0.807 . . . . 0.0 110.815 161.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -84.29 113.98 21.52 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 171.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.66 -32.64 74.4 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.066 0.547 . . . . 0.0 112.349 -177.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -69.99 -22.66 63.11 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.391 0.677 . . . . 0.0 110.885 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -78.18 89.32 4.26 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.971 0.908 . . . . 0.0 108.647 174.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.0 m -125.98 137.0 53.65 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.603 0.761 . . . . 0.0 111.267 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.3 tp -136.3 136.29 39.63 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -119.54 122.85 42.55 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.0 p -128.76 149.45 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 123.935 0.894 . . . . 0.0 110.562 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 p -92.93 108.94 20.39 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 28' ' ' LEU . 28.1 tp -103.91 134.33 47.38 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.456 1.102 . . . . 0.0 109.494 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.9 t -79.0 145.72 33.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.627 ' HB2' ' HB2' ' A' ' 83' ' ' ALA . 33.6 ptt180 -68.41 -13.51 62.35 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.753 0.421 . . . . 0.0 112.041 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -97.65 -21.71 16.88 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.115 0.966 . . . . 0.0 109.91 177.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.6 m -88.38 134.75 33.85 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.509 ' O ' HG22 ' A' ' 51' ' ' THR . 5.4 Cg_exo -71.11 163.39 39.36 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 122.71 2.273 . . . . 0.0 112.968 178.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 53' ' ' MET . 2.6 mm? -60.65 -22.94 64.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.479 1.112 . . . . 0.0 111.655 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.43 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -56.94 -38.29 72.72 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.302 0.641 . . . . 0.0 112.166 178.52 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.6 t -71.0 -28.77 64.66 Favored 'General case' 0 C--N 1.355 0.84 0 CA-C-O 120.862 0.363 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -74.58 -41.11 61.08 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 110.359 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -55.43 -48.93 73.68 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.785 0.834 . . . . 0.0 111.051 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.7 p -70.41 -33.63 71.58 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 113.868 -1.515 . . . . 0.0 109.61 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.11 -52.7 46.25 Favored 'General case' 0 C--N 1.354 0.787 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -55.84 -60.7 3.09 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 123.829 0.852 . . . . 0.0 111.506 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.43 -38.11 79.81 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.792 0.682 . . . . 0.0 112.749 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.66 -29.07 61.11 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.35 -50.33 9.03 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.087 0.555 . . . . 0.0 111.804 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 59.6 tpp -72.8 -22.91 60.74 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.428 1.091 . . . . 0.0 111.419 -172.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.04 35.39 4.25 Favored Glycine 0 C--N 1.354 1.583 0 O-C-N 122.128 -0.358 . . . . 0.0 113.23 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.16 123.65 40.99 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.055 0.942 . . . . 0.0 110.337 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.5 t -156.9 169.13 25.49 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 124.788 1.235 . . . . 0.0 108.971 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.82 -66.63 3.81 Favored Glycine 0 C--N 1.349 1.251 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -96.01 130.55 42.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.22 1.008 . . . . 0.0 109.331 170.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -99.75 144.18 29.12 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.471 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -116.55 155.16 29.16 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.029 0.932 . . . . 0.0 110.998 -167.866 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.1 m -91.58 163.51 14.1 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.99 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 35.4 m-85 -129.02 130.45 46.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.319 1.048 . . . . 0.0 108.968 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -130.44 129.02 42.46 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.726 0.81 . . . . 0.0 111.485 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -119.2 111.99 18.93 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.632 1.573 . . . . 0.0 107.673 172.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 51.56 40.69 27.61 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.065 0.936 . . . . 0.0 112.011 -177.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 81.54 -19.28 9.14 Favored Glycine 0 N--CA 1.478 1.457 0 CA-C-N 115.012 -0.994 . . . . 0.0 114.589 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.7 m -71.23 116.03 11.07 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.458 0.703 . . . . 0.0 109.919 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -70.87 113.69 8.18 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.33 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.22 116.23 13.51 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 m -74.06 -35.68 64.29 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.153 0.981 . . . . 0.0 111.886 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.15 -56.25 0.51 Allowed Glycine 0 C--N 1.347 1.165 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.925 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -89.77 10.29 24.06 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -167.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.512 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.9 OUTLIER -86.43 148.46 25.55 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 175.415 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.1 mt -101.39 149.84 36.69 Favored Pre-proline 0 C--N 1.315 -0.92 0 C-N-CA 124.993 1.317 . . . . 0.0 109.18 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 56.7 Cg_endo -66.13 -24.79 51.4 Favored 'Trans proline' 0 C--N 1.377 2.073 0 C-N-CA 122.07 1.846 . . . . 0.0 111.44 179.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.627 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . . . -60.64 -47.45 86.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.813 0.845 . . . . 0.0 110.267 170.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -71.17 -32.68 69.2 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.808 -175.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.512 HD21 ' HG3' ' A' ' 80' ' ' GLU . 72.9 mt -75.63 -23.04 56.3 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.551 0.74 . . . . 0.0 111.175 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.41 52.62 4.72 Favored Glycine 0 C--N 1.344 1.026 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 -175.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 71.5 mtp -97.58 174.87 6.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.678 0.791 . . . . 0.0 110.148 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.5 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 38.6 tt0 -133.99 155.8 49.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.241 0.616 . . . . 0.0 110.576 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 p -63.05 115.19 4.21 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 165.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.54 52.63 3.3 Favored Glycine 0 C--N 1.342 0.879 0 N-CA-C 111.613 -0.595 . . . . 0.0 111.613 -169.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t70 -110.07 -159.46 0.68 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.4 tp -142.93 143.54 32.04 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.865 0.841 . . . . 0.0 110.576 -175.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.2 mt -139.3 150.78 22.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 C-N-CA 126.472 1.909 . . . . 0.0 106.734 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -121.68 168.04 12.24 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 109.625 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.666 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 44.0 t -142.41 105.3 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 -174.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -114.75 94.9 4.97 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.736 0.779 . . . . 0.0 109.636 -175.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.581 0 CA-C-N 114.119 -1.4 . . . . 0.0 110.306 -179.169 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.4 m . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.77 -41.59 6.82 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 174.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -111.26 120.36 41.99 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -66.41 86.86 0.11 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.403 0.681 . . . . 0.0 112.368 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.41 -48.54 16.95 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -131.02 154.56 48.07 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 124.437 1.095 . . . . 0.0 108.569 174.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 82' ' ' PRO . 77.2 mt -108.21 125.98 52.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.886 1.274 . . . . 0.0 109.53 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.53 102.92 14.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 42.4 mt -110.39 131.44 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.08 0.552 . . . . 0.0 109.75 -173.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 92' ' ' LEU . 64.4 mtt85 -94.3 109.94 21.72 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.518 0.727 . . . . 0.0 109.213 -178.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -101.13 127.63 54.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.451 ' HG2' HG23 ' A' ' 38' ' ' THR . 70.8 mt-30 -134.45 153.1 52.1 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -177.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.534 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -90.97 -177.77 43.58 Favored Glycine 0 N--CA 1.463 0.435 0 O-C-N 123.399 0.437 . . . . 0.0 112.766 175.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -48.43 -16.45 0.11 Allowed 'General case' 0 CA--C 1.562 1.435 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 164.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.08 135.39 55.2 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.623 1.169 . . . . 0.0 109.225 172.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.93 -14.02 61.37 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.354 0.662 . . . . 0.0 112.127 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -64.15 -35.03 79.44 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 173.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.464 ' HG2' ' OH ' ' A' ' 56' ' ' TYR . 40.7 tt0 -90.07 87.04 6.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.679 173.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.451 HG23 ' HG2' ' A' ' 31' ' ' GLN . 90.7 m -129.33 141.5 51.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.715 0.806 . . . . 0.0 109.829 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 tp -142.59 144.66 32.96 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.585 1.154 . . . . 0.0 108.158 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -120.22 115.68 24.09 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.42 150.05 27.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 123.936 0.894 . . . . 0.0 110.134 -170.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.7 m -92.21 108.57 20.05 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.7 tp -105.54 123.59 48.15 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.2 m -72.87 147.71 45.11 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -177.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.34 -27.69 68.68 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.955 0.902 . . . . 0.0 112.482 -171.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -101.07 -12.05 19.15 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.549 0.739 . . . . 0.0 111.006 -178.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 67.7 m -83.82 134.8 43.66 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 123.293 0.637 . . . . 0.0 109.819 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.586 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 2.7 Cg_exo -67.78 158.01 59.19 Favored 'Trans proline' 0 C--N 1.368 1.554 0 C-N-CA 122.707 2.271 . . . . 0.0 113.122 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.65 HD11 ' HE1' ' A' ' 87' ' ' MET . 4.0 mm? -54.24 -30.78 51.43 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.782 1.233 . . . . 0.0 111.974 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.586 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.57 -34.37 69.13 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.487 HG22 ' O ' ' A' ' 48' ' ' PRO . 2.8 t -71.77 -33.01 68.27 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 120.862 0.363 . . . . 0.0 110.936 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 tt -68.43 -41.76 79.89 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.539 1.135 . . . . 0.0 110.356 173.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.464 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.5 -48.31 81.22 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.189 0.995 . . . . 0.0 109.74 176.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 t -63.1 -38.73 92.36 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 113.998 -1.455 . . . . 0.0 110.901 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -63.02 -50.1 72.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.004 0.522 . . . . 0.0 110.06 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.495 ' CE2' HG21 ' A' ' 95' ' ' VAL . 48.2 t80 -55.82 -57.03 13.74 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.558 1.143 . . . . 0.0 112.389 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -65.77 -42.5 90.77 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.374 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -63.8 -38.22 90.28 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.85 -52.59 63.5 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.753 0.821 . . . . 0.0 113.098 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.5 mtm -102.17 35.73 2.32 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 122.939 0.496 . . . . 0.0 111.683 -175.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 49.27 37.52 24.59 Favored Glycine 0 C--N 1.348 1.196 0 N-CA-C 117.586 1.794 . . . . 0.0 117.586 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -90.84 36.0 0.9 Allowed 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 117.68 0.74 . . . . 0.0 109.923 167.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 m -65.19 104.82 0.97 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.799 0.84 . . . . 0.0 110.109 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.8 -36.97 3.94 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 111.481 -0.648 . . . . 0.0 111.481 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -88.55 78.48 7.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.694 0.798 . . . . 0.0 109.18 177.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -79.59 144.64 33.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.589 0.356 . . . . 0.0 110.37 -176.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.459 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -120.91 157.19 30.4 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.89 1.276 . . . . 0.0 108.95 -178.917 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.421 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 17.4 m -77.23 153.06 34.4 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.859 0.463 . . . . 0.0 111.089 -176.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -125.61 125.61 43.41 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.084 0.954 . . . . 0.0 109.317 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -124.86 143.67 50.71 Favored 'General case' 0 C--O 1.212 -0.881 0 C-N-CA 124.001 0.92 . . . . 0.0 109.973 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -118.91 105.48 11.53 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.6 t70 55.76 28.33 12.11 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 124.145 0.978 . . . . 0.0 111.691 -170.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.04 1.5 79.38 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.692 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.3 m -79.1 119.62 22.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.474 0.71 . . . . 0.0 109.413 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.65 114.01 8.31 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.6 mt -83.4 126.69 33.0 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -83.38 -34.44 25.57 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.507 0.723 . . . . 0.0 111.845 -175.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.99 -60.87 0.56 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.57 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 57.3 mtp85 -84.02 5.96 23.84 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -169.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.6 pm0 -76.31 147.86 37.9 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 170.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -100.1 162.7 20.15 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 124.424 1.09 . . . . 0.0 108.883 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.494 ' HB2' HD12 ' A' ' 26' ' ' LEU . 62.9 Cg_endo -66.8 -23.51 48.05 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 121.606 1.537 . . . . 0.0 111.01 174.009 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.97 -32.95 73.72 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.919 0.887 . . . . 0.0 111.244 171.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.61 -47.63 21.73 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.723 0.809 . . . . 0.0 110.922 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.492 HD21 ' HG3' ' A' ' 80' ' ' GLU . 77.3 mt -72.13 -15.29 61.98 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.32 0.648 . . . . 0.0 111.404 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.36 28.36 55.82 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.529 0.518 . . . . 0.0 112.534 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.65 ' HE1' HD11 ' A' ' 49' ' ' LEU . 66.2 mtm -84.36 168.21 15.8 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.72 0.808 . . . . 0.0 111.593 177.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -155.87 169.3 24.73 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.715 1.206 . . . . 0.0 108.367 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 m -57.39 112.25 1.35 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.26 0.624 . . . . 0.0 110.911 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 122.71 -14.21 8.6 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-O 119.624 -0.542 . . . . 0.0 113.629 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.49 170.46 1.02 Allowed 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 175.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 29' ' ' ARG . 43.9 tp -132.61 111.7 11.43 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.877 -169.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 56.8 mt -100.63 152.31 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.525 1.13 . . . . 0.0 108.182 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -115.45 163.33 15.88 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.687 1.195 . . . . 0.0 108.741 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.534 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 22.3 t -136.97 110.1 8.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 124.465 1.106 . . . . 0.0 108.994 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.8 m95 -108.77 93.62 4.62 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.943 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 -177.002 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 121.027 0.441 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -100.1 -44.52 5.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.05 0.94 . . . . 0.0 110.044 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 65.9 p -101.74 121.29 41.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.1 m -73.68 70.3 1.35 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 122.208 1.004 . . . . 0.0 112.363 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -80.75 -38.27 28.96 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.026 1.33 . . . . 0.0 108.328 169.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 10.4 pt20 -113.88 151.28 32.41 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.3 -1.318 . . . . 0.0 109.019 171.063 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.424 HD12 ' HB2' ' A' ' 82' ' ' PRO . 53.5 mt -114.29 128.91 56.58 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.47 1.508 . . . . 0.0 109.448 177.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.23 105.17 17.28 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.05 135.66 52.41 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.822 0.849 . . . . 0.0 109.831 -169.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 81.6 mtt180 -95.38 111.99 23.78 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.823 0.849 . . . . 0.0 110.313 -177.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.17 129.97 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.987 0.915 . . . . 0.0 109.874 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -131.05 146.67 52.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.76 0.824 . . . . 0.0 108.923 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.63 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -86.49 -177.02 49.61 Favored Glycine 0 N--CA 1.466 0.693 0 C-N-CA 121.603 -0.332 . . . . 0.0 113.138 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 33' ' ' LYS . 48.6 mtpt -29.66 -46.14 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 125.394 1.478 . . . . 0.0 112.649 159.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -88.49 114.74 25.42 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -71.98 -20.28 61.75 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.11 0.564 . . . . 0.0 111.847 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -68.47 -27.63 66.33 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.022 0.529 . . . . 0.0 110.225 170.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -74.27 87.6 1.98 Allowed 'General case' 0 C--N 1.354 0.779 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.7 m -115.63 136.57 52.93 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.64 0.776 . . . . 0.0 110.172 -172.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -137.12 151.15 48.52 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.869 1.268 . . . . 0.0 107.582 173.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.613 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.0 pt-20 -131.3 126.35 35.13 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -135.23 147.72 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.798 -172.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.8 m -92.77 110.81 22.26 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.57 0.748 . . . . 0.0 109.042 -178.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 32.7 tp -110.26 130.79 55.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.328 1.051 . . . . 0.0 109.594 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 20.8 t -75.41 145.76 41.32 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.63 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.63 -21.36 65.62 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -172.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -106.17 -7.86 17.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.905 0.882 . . . . 0.0 111.849 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.9 m -90.37 134.54 30.97 Favored Pre-proline 0 CA--C 1.543 0.689 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.532 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 8.1 Cg_exo -63.5 155.35 63.09 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.899 2.4 . . . . 0.0 113.403 -178.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.0 mm? -53.28 -30.36 38.2 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 124.561 1.145 . . . . 0.0 111.874 173.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.532 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.85 -37.05 73.17 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.077 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.507 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -68.52 -33.47 74.17 Favored 'General case' 0 CA--C 1.561 1.367 0 CA-C-O 121.053 0.454 . . . . 0.0 110.759 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 tt -70.61 -38.33 73.97 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.718 1.207 . . . . 0.0 110.177 173.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.477 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 62.2 mtt -60.5 -40.02 89.85 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.212 1.005 . . . . 0.0 111.155 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -65.49 -38.44 89.75 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.477 1.111 . . . . 0.0 110.182 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -67.33 -47.55 70.16 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.611 0.364 . . . . 0.0 110.409 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.5 -55.83 27.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.406 0.682 . . . . 0.0 111.677 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.52 -38.15 88.85 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 123.674 0.609 . . . . 0.0 112.149 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -66.81 -47.75 71.07 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.569 0.348 . . . . 0.0 111.612 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.76 -48.48 74.4 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.113 0.965 . . . . 0.0 112.185 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.424 ' HB3' HD23 ' A' ' 62' ' ' LEU . 35.8 tpp -81.55 17.32 1.44 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 124.217 1.007 . . . . 0.0 112.431 -171.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 55.71 26.87 47.88 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 -176.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 60' ' ' MET . 3.6 mm? -85.76 22.48 1.63 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.051 0.94 . . . . 0.0 111.747 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.5 p -72.38 87.55 1.16 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.765 0.826 . . . . 0.0 110.381 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.54 -48.76 0.09 OUTLIER Glycine 0 C--N 1.343 0.95 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.756 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -132.68 134.63 45.06 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.124 0.969 . . . . 0.0 108.753 177.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -83.58 138.7 33.26 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 176.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.475 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -116.98 156.98 26.53 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.622 1.169 . . . . 0.0 109.921 -171.599 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.493 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 74.9 m -99.39 175.08 5.98 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.498 0.719 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -141.51 139.03 33.18 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.448 1.099 . . . . 0.0 109.553 -163.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -123.28 143.45 50.05 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.0 0.92 . . . . 0.0 110.664 174.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.528 ' HB3' HD21 ' A' ' 76' ' ' LEU . 66.4 t80 -129.6 106.12 8.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 171.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.12 26.94 16.8 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.445 1.098 . . . . 0.0 110.761 -170.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 90.55 -13.12 66.35 Favored Glycine 0 C--N 1.349 1.278 0 CA-C-N 115.635 -0.712 . . . . 0.0 113.595 -176.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.6 m -68.5 126.68 30.42 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.444 0.698 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.493 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 21.7 tptm -68.85 113.2 6.06 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 123.714 0.634 . . . . 0.0 109.896 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.528 HD21 ' HB3' ' A' ' 71' ' ' PHE . 23.5 mt -88.13 111.4 21.54 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 174.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.9 t -80.58 -18.44 48.28 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.987 0.915 . . . . 0.0 111.04 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.38 -39.5 2.49 Favored Glycine 0 C--N 1.347 1.159 0 C-N-CA 123.094 0.378 . . . . 0.0 113.295 177.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -81.88 1.57 34.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.261 0.624 . . . . 0.0 112.0 -173.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -80.41 148.68 30.46 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 39.5 mt -101.67 153.38 37.95 Favored Pre-proline 0 C--N 1.306 -1.288 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 174.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.63 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.0 Cg_endo -66.81 -22.19 49.75 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.783 1.656 . . . . 0.0 111.354 176.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.81 98.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.669 0.787 . . . . 0.0 110.979 168.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -71.86 -45.49 61.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.925 0.89 . . . . 0.0 110.999 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.8 mt -75.8 -11.23 59.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.691 0.796 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.82 60.87 Favored Glycine 0 C--N 1.35 1.351 0 CA-C-N 116.946 -0.115 . . . . 0.0 113.238 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.432 ' HE1' HD11 ' A' ' 49' ' ' LEU . 61.2 mtt -73.0 161.85 30.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.022 0.929 . . . . 0.0 111.365 177.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -149.31 160.5 43.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.122 1.369 . . . . 0.0 107.696 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.9 t -60.07 111.74 1.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 176.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.65 -28.43 3.98 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-O 119.498 -0.612 . . . . 0.0 112.819 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.92 170.95 0.07 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 tp -132.55 109.58 9.87 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.812 -167.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.8 mt -96.41 152.79 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.235 1.014 . . . . 0.0 108.663 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -124.3 163.02 22.55 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -173.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.63 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 75.7 t -142.13 112.86 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 123.832 0.853 . . . . 0.0 109.231 -175.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.9 p-90 -103.71 143.39 32.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 172.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.275 0 CA-C-O 118.923 -0.932 . . . . 0.0 112.098 178.952 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 . . . . . 0 N--CA 1.474 0.742 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' ' 82' ' ' PRO . 71.4 mt -106.03 126.67 52.47 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.599 1.16 . . . . 0.0 109.072 -177.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -88.53 102.16 14.65 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 54.6 mt -109.04 129.4 55.46 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.851 0.861 . . . . 0.0 109.581 -171.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.657 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 58.9 mtt180 -87.64 105.86 17.63 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -99.76 114.22 37.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -137.05 145.51 44.11 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.592 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.339 0.73 0 O-C-N 123.423 0.452 . . . . 0.0 113.588 -173.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 91.3 m . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.1 tp -143.24 153.58 42.96 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.002 0.365 . . . . 0.0 110.218 169.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.657 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 12.4 pt-20 -133.78 133.97 42.34 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 164.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -142.05 153.98 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 123.61 0.764 . . . . 0.0 109.785 -174.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.6 m -93.26 107.28 19.13 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.6 tp -95.13 128.86 42.3 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.1 t -72.48 141.44 48.57 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.475 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.42 -28.53 69.86 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.18 0.592 . . . . 0.0 112.156 -171.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -91.09 -18.09 25.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.909 0.884 . . . . 0.0 111.524 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -94.05 129.11 38.58 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 123.525 0.73 . . . . 0.0 109.44 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.482 ' O ' HG22 ' A' ' 51' ' ' THR . 8.4 Cg_endo -67.12 161.98 40.37 Favored 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.583 2.188 . . . . 0.0 114.174 -175.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.45 -30.32 40.1 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 125.496 1.519 . . . . 0.0 112.207 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -38.39 72.84 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.482 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -69.37 -28.68 66.41 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.883 179.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -74.37 -39.08 62.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.143 0.977 . . . . 0.0 110.268 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -60.54 -42.37 96.4 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.992 0.917 . . . . 0.0 111.213 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 p -71.27 -37.27 71.9 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -65.23 -48.81 71.99 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.132 0.573 . . . . 0.0 110.429 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -53.15 -57.46 10.39 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.58 1.552 . . . . 0.0 112.235 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -60.04 -41.19 91.73 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.779 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.83 -40.58 95.78 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.149 0 C-N-CA 123.632 0.773 . . . . 0.0 112.589 -179.789 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -78.59 155.37 29.66 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.431 0.692 . . . . 0.0 111.691 -177.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -131.58 130.89 42.81 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.165 0.986 . . . . 0.0 109.582 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -128.53 146.66 50.77 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.288 1.035 . . . . 0.0 110.756 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.572 ' HB3' HD21 ' A' ' 76' ' ' LEU . 11.7 t80 -142.93 119.69 11.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.638 1.175 . . . . 0.0 108.565 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.0 t70 57.2 32.64 22.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.325 1.05 . . . . 0.0 111.042 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.13 -17.38 28.18 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.441 -0.799 . . . . 0.0 113.655 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 63.4 m -73.37 123.8 24.51 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 123.902 0.881 . . . . 0.0 110.572 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -70.32 114.24 8.26 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.572 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.7 mt -81.1 112.88 18.87 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 176.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.5 t -76.36 -21.77 55.68 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.55 0.74 . . . . 0.0 110.969 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.05 -31.84 6.07 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.49 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -91.75 9.73 31.35 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.09 0.956 . . . . 0.0 111.959 -172.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.433 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.0 pm0 -93.92 148.64 21.95 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 166.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 mt -94.69 155.83 38.98 Favored Pre-proline 0 C--N 1.314 -0.972 0 C-N-CA 125.213 1.405 . . . . 0.0 108.36 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.56 ' HB2' HD12 ' A' ' 26' ' ' LEU . 63.1 Cg_endo -67.18 -36.14 22.48 Favored 'Trans proline' 0 C--N 1.368 1.603 0 C-N-CA 121.575 1.516 . . . . 0.0 111.089 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -27.51 66.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.477 0.711 . . . . 0.0 111.184 174.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.05 -43.43 71.25 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.635 0.774 . . . . 0.0 110.844 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.433 HD21 ' HG3' ' A' ' 80' ' ' GLU . 83.9 mt -71.88 -21.46 61.65 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.732 0.813 . . . . 0.0 111.211 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.21 42.6 7.43 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 111.768 -0.533 . . . . 0.0 111.768 -178.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.407 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 73.9 mtp -95.55 165.11 12.5 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.92 0.888 . . . . 0.0 110.539 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.7 tp10 -147.8 162.46 39.17 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.409 0.684 . . . . 0.0 109.734 -177.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.7 p -59.64 119.87 8.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.718 0.807 . . . . 0.0 110.996 176.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.19 36.07 4.8 Favored Glycine 0 C--N 1.341 0.861 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.43 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t0 -98.38 -172.08 2.26 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.8 tp -142.43 109.91 5.71 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.7 mt -94.41 148.5 4.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 167.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -119.72 156.82 29.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.592 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 39.5 t -137.76 136.93 45.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -175.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 80.5 m95 . . . . . 0 N--CA 1.466 0.371 0 C-N-CA 123.998 0.919 . . . . 0.0 108.829 -175.403 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 . . . . . 0 C--O 1.24 0.565 0 CA-C-O 122.17 0.986 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.401 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 7.8 mp -98.79 109.15 21.95 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.131 -176.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -81.49 102.91 10.86 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.487 HD22 ' HB2' ' A' ' 91' ' ' ASP . 39.8 mt -108.7 135.84 49.27 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -174.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -91.84 130.02 37.69 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -121.89 117.84 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.487 HE21 HD11 ' A' ' 92' ' ' LEU . 39.6 mt-30 -132.1 139.44 48.48 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -172.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.463 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.34 0.779 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.2 tp -131.88 154.32 49.32 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.008 0.923 . . . . 0.0 108.634 176.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -132.49 134.11 44.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 162.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.68 149.76 33.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 124.194 0.998 . . . . 0.0 109.637 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.5 m -91.78 108.34 19.85 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.1 tp -96.32 131.13 43.16 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.04 0.936 . . . . 0.0 109.611 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.3 m -78.81 138.11 38.03 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.579 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.7 ptm180 -63.21 -23.83 67.6 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -175.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.08 -18.71 31.65 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.87 0.468 . . . . 0.0 110.533 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -92.28 134.19 28.74 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.168 0.987 . . . . 0.0 109.764 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.463 ' O ' HG22 ' A' ' 51' ' ' THR . 1.2 Cg_endo -70.43 164.92 33.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.558 2.172 . . . . 0.0 113.06 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -58.58 -24.63 61.26 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 111.921 178.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -34.61 71.56 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.453 0.701 . . . . 0.0 111.981 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.463 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.4 t -74.47 -31.85 62.38 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-O 120.812 0.339 . . . . 0.0 110.548 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -67.26 -42.11 84.45 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.547 1.139 . . . . 0.0 110.181 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 61.8 mtt -57.65 -47.24 82.8 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.12 0.968 . . . . 0.0 110.476 172.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 m -65.01 -30.47 71.46 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.679 1.237 . . . . 0.0 110.062 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -70.66 -56.6 6.08 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.79 -60.99 2.67 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.684 1.194 . . . . 0.0 112.521 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.3 pt-20 -60.71 -36.81 79.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -74.35 -34.76 63.48 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.115 0 C-N-CA 123.528 0.731 . . . . 0.0 111.011 -176.363 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.427 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.3 m -82.1 148.58 28.47 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.409 0.683 . . . . 0.0 109.665 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.463 ' HB3' HD23 ' A' ' 76' ' ' LEU . 45.1 m-85 -122.82 128.85 50.96 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -129.83 127.54 40.48 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.142 0.496 . . . . 0.0 111.714 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -122.45 106.95 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 107.86 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.2 t70 49.32 47.92 21.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.583 1.153 . . . . 0.0 111.485 -174.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 82.37 -22.34 6.37 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 114.778 -1.101 . . . . 0.0 114.212 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 m -71.21 111.92 6.93 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.324 0.65 . . . . 0.0 110.097 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -68.87 114.13 6.92 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.463 HD23 ' HB3' ' A' ' 69' ' ' PHE . 1.1 mm? -75.27 108.22 7.89 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 176.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.5 m -72.52 -29.18 63.37 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.13 0.972 . . . . 0.0 111.839 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.91 -58.13 0.58 Allowed Glycine 0 C--N 1.345 1.068 0 CA-C-N 116.687 -0.233 . . . . 0.0 113.116 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -88.74 10.58 20.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.737 0.815 . . . . 0.0 112.894 -166.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.572 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -86.35 149.1 25.27 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 170.403 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.5 mt -98.43 151.47 37.49 Favored Pre-proline 0 C--N 1.314 -0.976 0 C-N-CA 125.13 1.372 . . . . 0.0 108.975 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.579 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 40.0 Cg_endo -64.71 -36.1 43.0 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 121.829 1.686 . . . . 0.0 111.498 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.19 81.93 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.427 0.691 . . . . 0.0 111.151 173.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.49 -34.24 76.73 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.877 0.871 . . . . 0.0 111.322 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 80' ' ' GLU . 56.6 mt -80.77 -23.4 39.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.726 0.811 . . . . 0.0 111.79 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.45 22.85 25.63 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.7 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.447 ' HE3' HD13 ' A' ' 85' ' ' LEU . 52.7 mtt -74.28 168.95 18.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.169 0.988 . . . . 0.0 111.093 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HG2' ' H ' ' A' ' 89' ' ' SER . 34.6 tt0 -154.57 174.04 15.49 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -179.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 28.5 p -62.61 13.97 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.66 63.68 0.3 Allowed Glycine 0 C--N 1.347 1.145 0 CA-C-N 118.61 0.641 . . . . 0.0 111.614 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.487 ' HB2' HD22 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -110.58 -171.73 1.89 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.601 0.76 . . . . 0.0 110.318 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.487 HD11 HE21 ' A' ' 31' ' ' GLN . 49.0 tp -139.46 144.63 38.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.414 0.686 . . . . 0.0 109.435 -173.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.1 mt -134.09 136.23 53.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -125.12 100.97 6.8 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -170.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.463 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 34.0 t -71.66 128.54 34.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.788 174.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.7 m95 . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 169.544 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.547 0 CA-C-O 121.726 0.774 . . . . 0.0 112.641 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 mt -109.57 145.6 36.09 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 125.959 1.704 . . . . 0.0 108.742 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -83.01 98.42 9.25 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 175.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.433 HD13 HD11 ' A' ' 93' ' ' ILE . 77.0 mt -107.75 121.89 45.63 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.449 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 82.6 mtt85 -88.87 133.75 34.18 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -125.75 129.69 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -133.38 144.36 49.53 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.036 0.534 . . . . 0.0 110.08 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.612 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.345 1.052 0 O-C-N 123.654 0.596 . . . . 0.0 112.685 175.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -140.0 131.26 26.62 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.543 1.137 . . . . 0.0 108.042 -178.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.449 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.8 pt-20 -119.01 125.15 48.7 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.63 153.87 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.56 -171.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 m -91.42 108.68 20.06 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.451 HD21 HD22 ' A' ' 49' ' ' LEU . 23.1 tp -107.1 124.75 50.13 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 122.872 0.469 . . . . 0.0 109.746 175.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.602 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 43.1 m -72.52 134.99 45.54 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.641 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.0 ptm180 -73.55 -11.32 60.4 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -171.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -92.45 -17.58 24.37 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.865 0.866 . . . . 0.0 110.325 171.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -94.18 143.88 27.12 Favored Pre-proline 0 C--N 1.354 0.761 0 C-N-CA 124.013 0.925 . . . . 0.0 109.701 -178.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.478 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -72.81 160.57 45.86 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.706 2.271 . . . . 0.0 112.928 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.514 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.1 mm? -56.64 -23.94 44.84 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.399 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -37.55 73.77 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -71.0 -27.88 64.02 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.008 0.433 . . . . 0.0 110.911 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -74.0 -41.18 62.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.945 0.898 . . . . 0.0 110.286 172.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -55.35 -44.28 75.81 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.057 0.943 . . . . 0.0 110.781 176.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -72.26 -35.97 68.92 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.443 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -70.22 -48.11 58.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.263 0.625 . . . . 0.0 110.537 -175.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.3 -58.85 6.03 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.349 1.06 . . . . 0.0 111.621 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -58.59 -28.71 65.84 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.913 0.758 . . . . 0.0 112.409 -177.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.56 -40.65 63.78 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -172.954 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.44 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 120.801 0.334 . . . . 0.0 110.374 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.44 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 16.4 m -84.47 161.12 20.4 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.514 0.726 . . . . 0.0 110.623 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.428 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 32.0 m-85 -128.13 127.54 43.21 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.012 0.925 . . . . 0.0 109.156 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -123.08 137.13 55.01 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.77 0.828 . . . . 0.0 110.764 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.535 ' HB3' HD21 ' A' ' 76' ' ' LEU . 28.2 t80 -116.79 110.52 18.51 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.731 1.212 . . . . 0.0 108.318 174.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.1 t70 52.5 39.06 27.16 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-O 121.815 0.817 . . . . 0.0 111.019 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 71.52 22.52 78.62 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 114.91 -1.041 . . . . 0.0 114.656 -177.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.3 m -102.98 120.44 40.64 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.085 0.954 . . . . 0.0 109.128 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.0 114.99 6.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.91 0.484 . . . . 0.0 110.229 177.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.535 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.2 mt -84.6 120.89 26.88 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 27.4 m -77.13 -35.47 56.19 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.777 0.831 . . . . 0.0 112.509 -175.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.73 7.02 13.85 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 123.291 0.472 . . . . 0.0 113.49 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -127.59 10.89 6.71 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 124.036 0.934 . . . . 0.0 110.763 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.435 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.2 pm0 -105.08 147.84 27.45 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 174.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.99 154.17 37.45 Favored Pre-proline 0 C--N 1.311 -1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 108.579 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.641 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 44.7 Cg_endo -65.43 -29.35 53.69 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.749 1.632 . . . . 0.0 111.187 177.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.17 93.68 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.202 0.601 . . . . 0.0 110.596 172.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.03 -38.23 82.28 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.895 0.878 . . . . 0.0 111.909 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.435 HD21 ' HG3' ' A' ' 80' ' ' GLU . 70.2 mt -77.14 -24.77 51.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.649 0.779 . . . . 0.0 111.437 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.34 24.86 20.6 Favored Glycine 0 C--N 1.348 1.202 0 C-N-CA 122.036 -0.126 . . . . 0.0 113.035 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.514 ' HE1' HD11 ' A' ' 49' ' ' LEU . 63.1 mtt -74.76 170.63 15.48 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.304 1.041 . . . . 0.0 110.798 171.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -155.61 174.7 14.91 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 15.04 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -172.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.66 55.59 0.42 Allowed Glycine 0 C--N 1.342 0.903 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -106.97 -173.2 2.24 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.7 tp -140.02 134.74 31.84 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 121.72 0.771 . . . . 0.0 110.064 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.433 HD11 HD13 ' A' ' 28' ' ' LEU . 48.9 mt -127.94 151.95 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.558 1.543 . . . . 0.0 108.549 -178.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -116.78 165.04 13.76 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.504 1.121 . . . . 0.0 108.538 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.612 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 15.8 t -140.9 112.56 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.314 1.046 . . . . 0.0 108.805 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 m95 . . . . . 0 CA--C 1.537 0.46 0 C-N-CA 124.495 1.118 . . . . 0.0 108.947 -176.974 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 111.464 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt -113.29 150.16 32.89 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.787 1.635 . . . . 0.0 108.722 177.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.17 108.09 19.42 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.547 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.4 mm? -109.47 141.86 41.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -176.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -97.72 123.77 41.78 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.792 0.837 . . . . 0.0 109.42 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -110.17 116.6 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -177.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -132.06 139.06 48.41 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.744 0.418 . . . . 0.0 110.069 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.559 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.348 1.242 0 O-C-N 123.512 0.508 . . . . 0.0 113.892 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -140.33 126.14 19.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.84 127.09 51.59 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.543 0.687 . . . . 0.0 109.184 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -133.88 151.11 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.061 0.944 . . . . 0.0 111.474 -168.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 67.8 m -93.39 106.92 18.83 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.015 176.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 28' ' ' LEU . 28.9 tp -107.34 131.94 53.68 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.427 1.091 . . . . 0.0 109.309 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.518 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 35.1 m -77.8 144.64 36.94 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.655 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 11.9 ptm85 -71.05 -9.32 57.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.575 0.35 . . . . 0.0 111.934 -175.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -94.86 -30.84 13.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.415 1.086 . . . . 0.0 109.849 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 m -82.11 139.28 45.72 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.969 0.907 . . . . 0.0 109.962 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.547 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 16.4 Cg_exo -62.21 153.79 67.41 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.962 2.441 . . . . 0.0 113.6 177.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.7 mm? -53.59 -29.5 37.86 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.596 170.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.547 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -58.22 -36.96 73.93 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.08 0.552 . . . . 0.0 112.428 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.84 -33.23 75.36 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 120.976 0.417 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -73.29 -42.61 62.21 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.929 1.292 . . . . 0.0 110.792 173.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.436 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 65.9 mtt -57.06 -46.04 82.76 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.444 1.098 . . . . 0.0 110.503 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 p -69.67 -33.78 73.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.272 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.46 -52.19 59.26 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.625 0.77 . . . . 0.0 110.538 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.431 ' CZ ' HG21 ' A' ' 95' ' ' VAL . 52.5 t80 -52.92 -60.2 3.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 111.831 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.9 pt-20 -57.87 -34.19 69.5 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 124.283 0.99 . . . . 0.0 111.986 -177.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.81 -47.4 85.29 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 173.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.281 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -173.54 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.459 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.697 0 CA-C-O 121.007 0.432 . . . . 0.0 111.434 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.9 m -99.64 152.99 19.44 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.702 0.801 . . . . 0.0 110.169 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -115.59 127.25 55.09 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.751 0.82 . . . . 0.0 109.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -122.79 140.96 52.35 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.931 0.892 . . . . 0.0 110.005 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.508 ' HB3' HD21 ' A' ' 76' ' ' LEU . 67.2 t80 -129.74 114.17 15.64 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.941 0.896 . . . . 0.0 108.661 174.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 56.61 34.29 24.2 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.382 1.073 . . . . 0.0 110.459 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 79.09 -2.65 68.97 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.397 -0.819 . . . . 0.0 114.243 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 97.1 m -81.49 126.87 32.19 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 117.663 0.731 . . . . 0.0 110.233 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -71.27 116.02 11.11 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 123.735 0.647 . . . . 0.0 109.65 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.508 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.6 mt -87.51 130.32 34.76 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -92.45 -25.0 18.65 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.659 0.784 . . . . 0.0 111.489 -177.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.93 -41.56 1.77 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 123.167 0.413 . . . . 0.0 113.092 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -76.71 -18.75 58.32 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.985 0.914 . . . . 0.0 112.591 -170.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.53 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.8 pm0 -71.99 149.1 45.29 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.6 mt -103.95 152.02 38.99 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.655 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 43.3 Cg_endo -64.03 -21.94 68.12 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.06 1.84 . . . . 0.0 111.708 -178.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.56 -44.35 89.66 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.054 0.941 . . . . 0.0 111.588 171.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -74.72 -39.71 61.74 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.614 0.766 . . . . 0.0 111.535 -176.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.53 HD21 ' HG3' ' A' ' 80' ' ' GLU . 95.0 mt -69.81 -23.27 63.3 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.07 0.548 . . . . 0.0 111.476 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.91 55.8 3.24 Favored Glycine 0 C--N 1.344 0.977 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 -174.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.444 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 61.0 mtp -107.74 159.62 16.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.075 0.95 . . . . 0.0 109.33 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -148.59 165.94 29.76 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.7 t -59.92 108.65 0.79 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 131.52 -31.95 3.02 Favored Glycine 0 C--N 1.354 1.534 0 CA-C-O 119.363 -0.687 . . . . 0.0 113.669 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.409 ' HB2' HD12 ' A' ' 28' ' ' LEU . 1.2 m-20 -54.15 167.24 0.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -177.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.7 tp -131.61 110.48 10.97 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 121.468 0.652 . . . . 0.0 109.538 -162.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.42 HD11 ' HE1' ' A' ' 87' ' ' MET . 38.3 mt -90.65 148.75 4.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.354 173.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -114.92 156.91 24.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -171.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.559 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 19.0 t -135.04 109.23 11.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 m0 . . . . . 0 CA--C 1.542 0.642 0 CA-C-N 114.398 -1.273 . . . . 0.0 108.043 -176.65 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.3 mt -97.1 123.54 40.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.449 1.5 . . . . 0.0 107.734 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -85.73 103.26 14.36 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -178.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 44.2 mt -111.25 132.87 54.01 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -175.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 mtt85 -99.48 126.86 45.49 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.95 133.03 52.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.704 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -139.9 153.43 46.97 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.884 0.873 . . . . 0.0 108.936 174.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.546 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.34 0.764 0 O-C-N 123.526 0.516 . . . . 0.0 112.635 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.5 m . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.691 0.281 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 tp -137.71 134.88 35.89 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -109.77 125.36 52.62 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -134.26 146.68 30.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.794 0.838 . . . . 0.0 110.605 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.7 p -95.55 107.68 19.87 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 175.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HB2' HD12 ' A' ' 52' ' ' LEU . 26.5 tp -88.49 131.14 35.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.547 -0.752 . . . . 0.0 108.992 175.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -73.82 139.88 45.41 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -61.91 -27.94 69.18 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.471 0.708 . . . . 0.0 112.477 -171.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -86.85 -27.76 23.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.101 0.96 . . . . 0.0 111.277 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -84.9 133.78 42.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.484 0.714 . . . . 0.0 110.842 -168.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.546 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 6.1 Cg_exo -60.09 157.05 36.22 Favored 'Trans proline' 0 C--N 1.378 2.113 0 C-N-CA 122.74 2.293 . . . . 0.0 113.085 177.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.489 HD11 ' HE1' ' A' ' 87' ' ' MET . 4.0 mm? -55.02 -26.98 40.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.581 1.152 . . . . 0.0 112.236 176.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.0 pttt -59.49 -33.3 71.16 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 48' ' ' PRO . 3.0 t -68.76 -32.48 72.25 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.343 0.592 . . . . 0.0 110.21 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' ' 43' ' ' LEU . 7.0 tt -74.15 -38.69 63.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.925 1.29 . . . . 0.0 110.376 173.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.9 mtt -59.04 -41.29 87.48 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.014 0.926 . . . . 0.0 110.592 176.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 24.1 m -64.44 -41.85 96.33 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 124.634 1.209 . . . . 0.0 109.789 176.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.42 -50.1 74.2 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.074 0.55 . . . . 0.0 110.495 -176.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -55.42 -58.01 9.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.958 0.903 . . . . 0.0 112.178 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.98 -39.1 93.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.982 -174.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 54' ' ' SER . 30.6 mm-40 -65.76 -46.33 79.19 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.102 0 C-N-CA 124.302 1.041 . . . . 0.0 113.566 -171.167 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.49 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 17.5 m -85.68 150.69 24.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.484 0.714 . . . . 0.0 110.347 -176.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -119.89 130.11 54.69 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.711 0.804 . . . . 0.0 109.88 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.451 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 17.6 m-85 -124.63 155.59 38.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.009 0.924 . . . . 0.0 110.335 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.516 ' HB3' HD21 ' A' ' 76' ' ' LEU . 56.9 t80 -140.25 112.32 7.65 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.37 1.068 . . . . 0.0 108.956 172.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 57.3 32.12 21.23 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.355 1.062 . . . . 0.0 110.995 -174.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.22 -0.45 89.71 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.645 -1.161 . . . . 0.0 114.28 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 86.3 m -83.54 122.12 28.14 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.346 0.658 . . . . 0.0 110.084 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -67.42 114.32 6.01 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.516 HD21 ' HB3' ' A' ' 71' ' ' PHE . 30.6 mt -86.42 118.93 26.17 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -78.77 -30.56 45.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.72 0.808 . . . . 0.0 112.473 -176.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.6 -47.28 1.03 Allowed Glycine 0 CA--C 1.524 0.604 0 CA-C-N 116.302 -0.408 . . . . 0.0 112.827 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -77.09 -19.74 56.64 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.439 0.696 . . . . 0.0 112.532 -169.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.469 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -69.58 149.03 48.61 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.792 0.806 . . . . 0.0 109.459 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 65.3 mt -101.96 157.4 33.77 Favored Pre-proline 0 C--N 1.309 -1.194 0 C-N-CA 125.17 1.388 . . . . 0.0 108.626 -174.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -65.24 -35.02 42.96 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 121.827 1.685 . . . . 0.0 111.515 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.31 -36.39 79.99 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.716 0.806 . . . . 0.0 111.163 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.66 -46.55 75.35 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.995 0.918 . . . . 0.0 111.473 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.469 HD21 ' HG3' ' A' ' 80' ' ' GLU . 55.6 mt -75.34 -17.1 60.33 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.22 22.73 53.87 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.132 -0.486 . . . . 0.0 113.111 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.489 ' HE1' HD11 ' A' ' 49' ' ' LEU . 48.5 mtt -64.51 152.16 42.52 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.339 1.056 . . . . 0.0 112.165 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -146.91 157.23 43.58 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 -175.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 54.7 p -56.6 117.42 3.86 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.194 0.598 . . . . 0.0 111.173 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.09 -8.65 29.2 Favored Glycine 0 C--N 1.34 0.758 0 CA-C-O 119.603 -0.554 . . . . 0.0 113.501 178.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -60.06 160.33 8.21 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 117.446 0.623 . . . . 0.0 111.868 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.2 tp -124.77 108.79 12.34 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -163.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.6 mt -88.63 150.03 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 39.8 mt-10 -112.26 155.32 24.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.502 1.121 . . . . 0.0 108.216 -171.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.546 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 41.7 t -136.02 107.45 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.763 0.825 . . . . 0.0 108.836 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 9.7 m0 . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.461 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 8.6 mp0 . . . . . 0 CA--C 1.533 0.313 0 CA-C-O 121.213 0.53 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 69.9 mt -97.0 125.85 41.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.28 1.032 . . . . 0.0 108.256 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -77.26 99.0 5.33 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.6 mt -112.39 133.72 54.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.481 0.712 . . . . 0.0 109.598 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -96.5 136.39 37.07 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.437 HG13 ' HB ' ' A' ' 93' ' ' ILE . 1.9 t -125.01 134.05 67.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -132.6 146.96 52.3 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 118.221 0.464 . . . . 0.0 110.496 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.593 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.345 1.035 0 O-C-N 124.023 0.827 . . . . 0.0 112.26 171.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.9 m . . . . . 0 CA--C 1.54 0.591 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -140.76 132.57 27.46 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -120.88 129.48 53.52 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -174.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.4 p -132.14 149.53 32.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.841 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.2 p -94.98 105.78 17.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.0 tp -108.09 107.55 18.25 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.697 177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 26.9 m -32.92 120.49 0.35 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 113.093 158.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.647 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.7 ptm180 -64.03 -13.61 48.22 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -172.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 44.5 p-10 -98.68 -14.22 19.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.163 0.985 . . . . 0.0 111.092 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m -92.82 141.05 23.85 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.038 0.935 . . . . 0.0 110.124 -175.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.555 ' O ' HG22 ' A' ' 51' ' ' THR . 14.6 Cg_exo -61.12 149.33 89.69 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.313 2.675 . . . . 0.0 113.201 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.68 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.9 mm? -53.58 -29.86 39.37 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.036 -0.983 . . . . 0.0 112.336 172.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -54.89 -37.78 66.75 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.502 0.721 . . . . 0.0 112.307 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.555 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.4 t -69.42 -36.83 77.09 Favored 'General case' 0 CA--C 1.554 1.133 0 O-C-N 123.118 0.262 . . . . 0.0 110.58 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.01 -45.18 82.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.293 1.037 . . . . 0.0 110.531 175.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.495 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -54.94 -47.35 74.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.129 176.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 t -66.81 -33.79 76.4 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.463 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -67.29 -49.86 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.423 0.689 . . . . 0.0 110.159 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.449 ' CZ ' HG21 ' A' ' 95' ' ' VAL . 46.7 t80 -54.98 -60.77 2.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.167 0.987 . . . . 0.0 111.449 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.4 pt-20 -62.7 -39.38 93.81 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.549 -173.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.78 -37.75 85.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 175.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -179.827 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.452 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.971 0.415 . . . . 0.0 110.758 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.427 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 50.0 m -89.46 162.62 15.64 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.105 -177.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.47 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 45.2 m-85 -132.27 128.12 37.13 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.489 1.116 . . . . 0.0 109.249 -174.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.523 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 31.6 m-85 -125.15 122.66 37.74 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.54 0.736 . . . . 0.0 110.636 -177.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.569 ' HB3' HD21 ' A' ' 76' ' ' LEU . 27.5 t80 -98.73 106.89 19.21 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 52.01 46.11 27.15 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.259 1.023 . . . . 0.0 111.618 -171.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 76.5 1.03 69.28 Favored Glycine 0 C--N 1.347 1.175 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.907 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 54.5 m -86.64 113.02 22.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.499 0.72 . . . . 0.0 109.303 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -59.02 115.4 3.12 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.818 0.698 . . . . 0.0 109.512 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 71' ' ' PHE . 56.6 mt -88.5 127.65 35.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.131 0.972 . . . . 0.0 108.863 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.4 t -81.44 -25.55 36.05 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.697 0.799 . . . . 0.0 111.422 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.74 -47.86 1.0 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 123.78 0.705 . . . . 0.0 112.436 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -93.97 11.28 30.19 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.665 0.786 . . . . 0.0 112.365 -168.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.558 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -85.88 150.17 24.71 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 165.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.1 mt -102.26 160.37 26.57 Favored Pre-proline 0 C--N 1.309 -1.184 0 C-N-CA 124.806 1.242 . . . . 0.0 107.922 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.647 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 36.7 Cg_endo -67.22 -20.08 49.79 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.423 1.415 . . . . 0.0 111.839 171.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.88 92.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.4 0.68 . . . . 0.0 110.564 168.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -75.2 -45.46 40.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.038 0.935 . . . . 0.0 110.723 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.558 HD21 ' HG3' ' A' ' 80' ' ' GLU . 96.0 mt -68.66 -23.97 64.48 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.029 0.932 . . . . 0.0 112.783 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 71.53 64.51 2.71 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.68 ' HE1' HD11 ' A' ' 49' ' ' LEU . 30.7 ttp -128.39 153.78 46.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.35 1.06 . . . . 0.0 108.721 -173.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -149.49 167.18 26.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.598 0.759 . . . . 0.0 109.1 -170.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 m -55.71 117.85 4.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.463 0.705 . . . . 0.0 111.323 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 120.94 -21.79 8.24 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-O 119.816 -0.435 . . . . 0.0 113.245 177.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.32 169.29 0.89 Allowed 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.61 110.51 9.95 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.917 -166.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.437 ' HB ' HG13 ' A' ' 30' ' ' VAL . 62.1 mt -95.46 150.29 4.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.415 175.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 34.9 mt-10 -109.96 165.06 12.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.038 0.935 . . . . 0.0 108.7 -171.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.593 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 46.0 t -139.89 109.49 3.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 123.995 0.918 . . . . 0.0 108.912 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 74.2 m95 . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.574 1.149 . . . . 0.0 108.69 -178.074 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.448 ' OE1' ' HB3' ' A' ' 42' ' ' SER . 3.9 pp0? . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 122.065 0.936 . . . . 0.0 112.892 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.96 134.02 38.08 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.799 -160.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.62 103.37 15.76 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 45.2 mt -109.33 130.6 55.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.004 0.522 . . . . 0.0 109.935 -174.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -92.94 128.56 38.85 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.86 121.31 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -173.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -127.62 137.44 52.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.773 0.429 . . . . 0.0 109.887 -171.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.609 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.343 0.942 0 O-C-N 123.745 0.653 . . . . 0.0 112.46 176.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.1 m . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.68 122.83 20.4 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -115.46 122.72 46.63 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.025 0.917 . . . . 0.0 109.355 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.82 147.44 29.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.793 0 C-N-CA 125.045 1.338 . . . . 0.0 109.484 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.448 ' HB3' ' OE1' ' A' ' 25' ' ' GLN . 6.0 m -90.86 107.15 19.0 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 27.3 tp -104.71 131.61 51.95 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.749 0.82 . . . . 0.0 109.026 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.3 m -75.88 137.15 40.23 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.713 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 9.1 ptm180 -72.21 -6.79 45.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.742 0.306 . . . . 0.0 111.746 -175.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -92.4 -37.7 12.42 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.646 1.178 . . . . 0.0 109.887 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 m -78.01 132.55 67.06 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.599 0.76 . . . . 0.0 110.682 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.437 ' O ' HG22 ' A' ' 51' ' ' THR . 10.7 Cg_endo -64.54 162.07 32.6 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.545 2.163 . . . . 0.0 113.974 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.5 mm? -53.92 -28.03 34.32 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.433 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.83 -36.22 58.41 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -177.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 48' ' ' PRO . 10.9 t -73.26 -33.76 65.45 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 120.892 0.377 . . . . 0.0 111.129 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.72 -42.7 85.92 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.258 1.023 . . . . 0.0 110.322 172.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.41 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -58.63 -49.36 77.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.558 1.143 . . . . 0.0 110.636 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.8 p -67.15 -32.84 74.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 124.813 1.321 . . . . 0.0 109.778 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -67.43 -53.5 28.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 122.845 0.458 . . . . 0.0 110.065 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -55.27 -60.16 3.79 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.613 1.165 . . . . 0.0 111.389 -178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 53' ' ' MET . 12.3 pt-20 -56.91 -49.87 74.28 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.015 0.822 . . . . 0.0 110.901 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.26 -27.1 66.04 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.237 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 120.962 0.411 . . . . 0.0 109.998 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 41.3 m -87.82 130.81 34.75 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.495 -173.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -101.64 133.05 46.94 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.121 0.969 . . . . 0.0 110.035 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.488 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 98.3 m-85 -128.73 132.39 47.97 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.306 0.642 . . . . 0.0 111.175 177.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.473 ' HB3' HD21 ' A' ' 76' ' ' LEU . 15.7 t80 -120.63 108.52 14.12 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.6 t70 59.5 26.22 15.15 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-O 122.045 0.926 . . . . 0.0 110.456 -172.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.75 -2.9 87.33 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.517 -0.765 . . . . 0.0 114.272 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.44 ' O ' ' HA ' ' A' ' 70' ' ' PHE . 90.9 m -73.51 125.92 29.04 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 117.581 0.69 . . . . 0.0 110.197 175.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -68.66 114.03 6.67 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 123.62 0.575 . . . . 0.0 109.64 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.473 HD21 ' HB3' ' A' ' 71' ' ' PHE . 12.2 mt -93.95 124.59 38.05 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 175.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.2 m -111.56 -14.19 13.71 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.31 -63.17 0.54 Allowed Glycine 0 C--N 1.345 1.065 0 N-CA-C 113.599 0.2 . . . . 0.0 113.599 176.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -77.8 -5.14 49.79 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -167.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.4 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.6 pm0 -81.43 147.63 29.67 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 17.6 mt -99.6 153.16 37.91 Favored Pre-proline 0 C--N 1.312 -1.056 0 C-N-CA 125.343 1.457 . . . . 0.0 108.128 -176.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.713 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 50.0 Cg_endo -66.29 -36.23 28.74 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 121.768 1.645 . . . . 0.0 111.317 177.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.14 75.2 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.083 0.553 . . . . 0.0 110.966 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -65.94 -43.7 87.26 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.778 . . . . 0.0 110.624 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.4 HD21 ' HG3' ' A' ' 80' ' ' GLU . 50.6 mt -74.85 -24.83 58.65 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.63 0.772 . . . . 0.0 111.999 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 91.47 55.21 1.83 Allowed Glycine 0 C--N 1.343 0.919 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 63.4 mtt -104.34 161.87 13.7 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.986 0.914 . . . . 0.0 110.653 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.5 tp10 -148.9 160.42 43.27 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.928 0.891 . . . . 0.0 108.689 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 t -62.66 118.07 7.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.347 0.659 . . . . 0.0 110.72 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.34 41.19 3.04 Favored Glycine 0 C--N 1.34 0.771 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -173.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.5 t0 -103.9 -175.75 2.89 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.338 0.655 . . . . 0.0 109.444 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 30.9 tp -138.66 134.79 34.14 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.472 0.653 . . . . 0.0 109.447 -174.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 54.1 mt -126.54 150.39 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.923 1.289 . . . . 0.0 108.194 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.488 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 28.5 mt-10 -117.88 156.4 28.49 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 -171.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.609 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 10.2 t -140.14 139.41 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.567 0.747 . . . . 0.0 110.265 -174.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.1 m95 . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 124.812 1.245 . . . . 0.0 109.653 -175.528 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 . . . . . 0 C--O 1.238 0.488 0 CA-C-O 121.561 0.696 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 82' ' ' PRO . 44.6 mt -99.01 123.36 43.25 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.306 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -87.28 101.87 13.95 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.632 HD13 ' SD ' ' A' ' 87' ' ' MET . 28.2 mt -113.55 154.7 26.68 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.498 0.719 . . . . 0.0 111.203 -168.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.6 mtm105 -112.19 136.28 51.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.188 0.595 . . . . 0.0 110.955 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -120.29 126.04 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.216 1.407 . . . . 0.0 108.899 173.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -129.12 129.16 44.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.622 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.344 0.991 0 O-C-N 123.729 0.643 . . . . 0.0 113.63 -172.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.1 m . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.464 ' HB3' HG23 ' A' ' 30' ' ' VAL . 1.5 tm? -128.57 128.13 43.67 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -121.16 121.31 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.765 0.793 . . . . 0.0 109.542 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -128.15 144.83 36.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 124.817 1.247 . . . . 0.0 110.823 -171.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p -93.39 112.17 24.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.814 0.845 . . . . 0.0 109.489 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.445 ' HB3' HD12 ' A' ' 28' ' ' LEU . 36.8 tp -110.09 133.9 52.73 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.924 0.889 . . . . 0.0 109.41 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 67.3 m -77.18 147.08 36.66 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.656 0.382 . . . . 0.0 109.992 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.496 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 8.9 ptm180 -64.62 -25.9 68.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.663 0.785 . . . . 0.0 111.853 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -99.69 -16.05 18.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.258 1.023 . . . . 0.0 111.096 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.2 m -88.42 135.99 32.08 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.701 0.8 . . . . 0.0 109.438 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.524 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 2.8 Cg_endo -65.9 155.03 71.47 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 122.697 2.265 . . . . 0.0 113.283 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.04 -29.9 32.53 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 125.137 1.375 . . . . 0.0 112.255 176.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.524 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.2 pttt -55.96 -35.47 66.74 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.0 t -70.3 -32.85 70.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.0 tt -70.85 -37.6 73.12 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.599 1.16 . . . . 0.0 110.235 173.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.2 mtt -61.99 -42.09 98.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.01 0.924 . . . . 0.0 110.397 176.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.5 m -66.92 -38.58 86.47 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 124.534 1.146 . . . . 0.0 110.227 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.76 -45.6 70.98 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 122.989 0.516 . . . . 0.0 110.311 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.83 -57.96 9.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.219 1.008 . . . . 0.0 111.8 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -61.1 -42.51 98.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 123.946 0.779 . . . . 0.0 110.512 -174.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.58 -29.48 70.08 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 177.963 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 120.294 0.092 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.0 m -98.16 168.09 10.47 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.253 0.621 . . . . 0.0 111.156 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -130.99 132.12 44.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.159 1.383 . . . . 0.0 109.007 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -127.73 112.4 14.76 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.753 0.821 . . . . 0.0 110.603 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.531 ' HB3' HD21 ' A' ' 76' ' ' LEU . 10.8 t80 -102.23 111.72 24.11 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.677 1.191 . . . . 0.0 107.819 174.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.4 t70 52.47 36.16 19.52 Favored 'General case' 0 CA--C 1.564 1.495 0 CA-C-O 121.977 0.894 . . . . 0.0 110.836 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 85.75 -16.12 43.21 Favored Glycine 0 N--CA 1.478 1.466 0 CA-C-N 115.062 -0.972 . . . . 0.0 114.745 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.5 m -70.51 121.0 16.99 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.287 0.635 . . . . 0.0 110.789 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -71.23 119.71 15.75 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.531 HD21 ' HB3' ' A' ' 71' ' ' PHE . 45.0 mt -91.37 126.82 36.58 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 124.289 1.036 . . . . 0.0 109.403 -177.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.7 m -90.35 -22.97 21.25 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.892 0.877 . . . . 0.0 112.38 -176.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.21 -49.72 0.92 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 120.103 -0.276 . . . . 0.0 113.604 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.4 mtm180 -82.54 1.29 38.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.703 0.801 . . . . 0.0 112.866 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.422 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -85.26 148.12 26.22 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.4 156.8 34.82 Favored Pre-proline 0 C--N 1.313 -1.0 0 C-N-CA 125.045 1.338 . . . . 0.0 108.097 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 73.7 Cg_endo -69.32 -25.06 31.01 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 121.531 1.487 . . . . 0.0 111.126 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.48 83.97 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.324 0.649 . . . . 0.0 110.56 171.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -67.11 -40.5 86.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.422 ' HB3' ' CE2' ' A' ' 71' ' ' PHE . 88.5 mt -73.55 -23.61 60.0 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.198 0.999 . . . . 0.0 111.902 176.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.78 23.68 52.11 Favored Glycine 0 C--N 1.349 1.288 0 O-C-N 123.236 0.335 . . . . 0.0 112.858 -176.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.632 ' SD ' HD13 ' A' ' 28' ' ' LEU . 32.8 ttm -73.85 160.66 31.11 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.388 1.475 . . . . 0.0 110.848 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -140.04 157.19 46.04 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.094 0.957 . . . . 0.0 109.548 -176.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.5 m -56.45 119.49 6.13 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.358 0.663 . . . . 0.0 111.119 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.46 -15.37 32.47 Favored Glycine 0 N--CA 1.475 1.262 0 CA-C-O 119.727 -0.485 . . . . 0.0 113.91 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.64 175.85 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.54 1.136 . . . . 0.0 112.561 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.4 tp -130.79 107.66 9.3 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -172.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.1 mt -89.75 149.85 3.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 168.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -115.79 163.45 15.82 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.622 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 98.8 t -135.76 119.61 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.3 m95 . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 124.362 1.065 . . . . 0.0 109.333 -176.965 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 C--O 1.236 0.372 0 CA-C-O 121.654 0.74 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.9 mt -92.71 128.39 38.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.26 -163.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -83.85 99.82 10.57 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.479 HD13 ' SD ' ' A' ' 87' ' ' MET . 64.9 mt -110.89 130.77 55.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.868 0.867 . . . . 0.0 109.63 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 -99.15 112.11 24.33 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.018 0.527 . . . . 0.0 109.855 -176.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -100.48 119.65 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.914 0.886 . . . . 0.0 109.435 176.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -123.27 134.69 54.07 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -174.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.44 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.352 1.42 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 173.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 40.8 m . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -129.44 121.06 26.54 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -113.24 125.3 54.16 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.286 0.565 . . . . 0.0 109.72 -176.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -132.34 148.39 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.736 1.214 . . . . 0.0 110.599 -174.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.4 p -102.29 105.24 15.84 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.464 ' HB3' HD12 ' A' ' 28' ' ' LEU . 34.2 tp -91.53 135.84 33.56 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.573 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.4 m -74.19 136.69 42.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.468 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.7 ptm180 -71.51 -15.82 62.32 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -168.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.408 ' O ' HD22 ' A' ' 81' ' ' LEU . 28.8 t70 -92.67 -36.73 12.79 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.988 0.915 . . . . 0.0 110.336 172.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -66.71 143.0 97.88 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 123.545 0.738 . . . . 0.0 111.249 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.457 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -71.62 162.74 41.2 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.616 2.211 . . . . 0.0 113.1 176.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -56.06 -26.12 47.98 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.731 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.457 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 62.2 pttt -58.32 -37.53 75.27 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.44 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -70.56 -30.77 67.58 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 118.439 0.563 . . . . 0.0 110.82 178.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.99 -40.74 78.58 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.176 0.991 . . . . 0.0 110.428 172.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.41 -45.13 89.02 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.283 1.033 . . . . 0.0 110.046 175.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -66.28 -35.95 81.72 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 124.993 1.433 . . . . 0.0 110.703 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -68.88 -47.43 65.88 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.097 0.559 . . . . 0.0 110.258 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.36 -59.05 5.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.473 1.109 . . . . 0.0 111.819 177.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 53' ' ' MET . 10.5 pt-20 -62.54 -46.6 87.64 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.349 1.03 . . . . 0.0 111.401 -174.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -65.54 -34.53 78.47 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.237 0 C-N-CA 123.491 0.716 . . . . 0.0 112.301 178.121 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.789 0 CA-C-O 121.03 0.443 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.5 m -104.71 166.36 10.44 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.031 0.932 . . . . 0.0 110.451 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.427 ' HB3' HD12 ' A' ' 76' ' ' LEU . 65.2 m-85 -136.08 129.65 32.2 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.883 1.273 . . . . 0.0 108.722 -179.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.73 133.93 50.77 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.584 0.753 . . . . 0.0 111.023 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.466 ' HB3' HD21 ' A' ' 76' ' ' LEU . 54.2 t80 -129.13 116.61 19.49 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.533 1.133 . . . . 0.0 108.292 171.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.5 t70 59.05 30.47 20.28 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.492 1.117 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 87.68 -19.78 31.25 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 113.37 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.8 m -65.29 120.14 12.21 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.621 0.768 . . . . 0.0 110.494 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -68.88 113.52 6.38 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 71' ' ' PHE . 31.7 mt -82.62 119.44 24.28 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -85.94 -31.02 22.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.366 1.066 . . . . 0.0 112.315 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.7 10.49 23.04 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.803 -172.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -123.54 10.46 9.12 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.538 1.135 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -112.45 148.08 35.15 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.408 HD22 ' O ' ' A' ' 46' ' ' ASP . 14.7 mt -102.21 156.65 34.98 Favored Pre-proline 0 C--N 1.313 -0.991 0 C-N-CA 125.37 1.468 . . . . 0.0 107.767 177.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.5 Cg_endo -67.57 -21.43 46.03 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.407 1.405 . . . . 0.0 110.894 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.2 76.25 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.017 0.927 . . . . 0.0 110.719 170.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.08 -42.35 89.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.016 0.926 . . . . 0.0 111.431 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.8 mt -74.18 -24.47 59.38 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 76.37 68.7 1.49 Allowed Glycine 0 C--N 1.351 1.374 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -173.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.479 ' SD ' HD13 ' A' ' 28' ' ' LEU . 43.8 ttm -118.65 160.19 22.26 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.47 1.108 . . . . 0.0 109.8 -172.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -124.03 166.14 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.275 0.63 . . . . 0.0 109.986 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 t -76.63 15.22 0.66 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.172 0.989 . . . . 0.0 113.174 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -151.94 55.98 0.45 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -103.71 -175.05 2.69 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.033 -173.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.4 tp -143.84 107.38 4.61 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.5 mt -94.22 150.09 4.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.903 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -105.6 158.25 16.82 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.44 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.2 t -136.87 124.46 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 86.4 m95 . . . . . 0 N--CA 1.47 0.533 0 C-N-CA 123.618 0.767 . . . . 0.0 109.695 -176.55 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 . . . . . 0 CA--C 1.545 0.75 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.6 mt -107.32 134.84 49.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.918 1.287 . . . . 0.0 108.626 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -83.06 101.36 11.08 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 43' ' ' LEU . 90.3 mt -110.51 124.21 51.38 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.956 0.502 . . . . 0.0 111.225 -170.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -87.68 138.12 31.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.188 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.57 124.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 125.238 1.415 . . . . 0.0 108.103 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -122.97 129.05 51.05 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -175.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.668 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.877 0 N-CA-C 114.739 0.656 . . . . 0.0 114.739 -176.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 39.8 m . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -128.01 136.86 51.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -125.23 128.27 48.04 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.055 0.843 . . . . 0.0 110.272 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -133.96 144.25 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.451 1.1 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.2 m -94.14 107.23 19.17 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 28' ' ' LEU . 43.1 tp -93.48 134.97 35.18 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.009 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.3 m -77.68 141.2 39.52 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.457 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.1 ptm180 -63.4 -26.05 68.57 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.15 -15.98 24.15 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.784 0.834 . . . . 0.0 110.621 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.0 m -88.74 132.84 37.28 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.489 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -69.0 163.61 37.0 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.484 2.122 . . . . 0.0 113.359 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.43 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.1 mm? -57.26 -26.37 60.69 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.882 177.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.432 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 59.5 pttt -58.62 -36.89 74.78 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.3 t -72.56 -30.42 64.4 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-O 120.924 0.392 . . . . 0.0 110.661 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -71.7 -40.32 69.59 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.262 1.025 . . . . 0.0 110.304 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.486 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 63.4 mtt -56.37 -43.88 79.63 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.234 1.013 . . . . 0.0 110.462 173.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.0 t -64.1 -41.61 97.21 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 124.955 1.409 . . . . 0.0 109.837 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -66.91 -46.01 76.16 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.221 0.608 . . . . 0.0 110.962 -174.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.12 -60.85 2.91 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.699 0.8 . . . . 0.0 111.692 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.2 pt-20 -59.55 -40.6 87.83 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.91 0.757 . . . . 0.0 111.786 -176.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -64.97 -40.26 94.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.34 0 C-N-CA 123.674 0.789 . . . . 0.0 112.388 -179.114 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.413 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 121.135 0.493 . . . . 0.0 111.144 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.453 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 56.4 m -104.49 169.09 8.67 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.138 0.975 . . . . 0.0 109.885 176.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 18.4 m-85 -130.73 132.19 45.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.266 1.027 . . . . 0.0 109.0 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -127.76 121.87 31.35 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.852 0.861 . . . . 0.0 111.023 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.544 ' HB3' HD21 ' A' ' 76' ' ' LEU . 42.7 t80 -102.43 109.79 21.55 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 52.92 40.9 31.75 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.385 1.074 . . . . 0.0 111.087 -171.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 73.94 4.23 66.53 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 114.838 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 94.4 m -81.24 120.88 25.46 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.77 0.785 . . . . 0.0 109.185 173.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.453 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 3.1 tmtp? -69.42 113.12 6.44 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.544 HD21 ' HB3' ' A' ' 71' ' ' PHE . 33.5 mt -83.64 116.66 22.73 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.8 m -71.66 -27.31 62.98 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.844 0.858 . . . . 0.0 111.4 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 127.97 -44.38 1.24 Allowed Glycine 0 C--N 1.346 1.103 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.376 -177.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -80.47 -1.22 40.75 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -171.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -76.25 148.31 37.7 Favored 'General case' 0 C--N 1.347 0.467 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -102.87 149.86 37.22 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.998 1.319 . . . . 0.0 107.779 174.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 53.5 Cg_endo -66.5 -25.78 47.77 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 121.575 1.517 . . . . 0.0 111.298 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.21 96.99 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.664 0.786 . . . . 0.0 111.133 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.05 -43.48 74.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.761 0.825 . . . . 0.0 111.221 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 76.7 mt -72.17 -19.82 61.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.716 0.806 . . . . 0.0 111.757 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.94 51.24 5.93 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.521 ' SD ' HD13 ' A' ' 28' ' ' LEU . 41.7 ttm -106.36 156.55 18.4 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.831 1.252 . . . . 0.0 109.137 -174.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.9 tt0 -139.47 160.06 40.71 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.004 0.521 . . . . 0.0 110.89 -170.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.7 m -61.85 117.78 6.33 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.232 0.613 . . . . 0.0 110.333 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.15 48.77 4.47 Favored Glycine 0 C--N 1.338 0.676 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.6 t0 -102.87 -160.89 0.81 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.8 tp -142.75 109.79 5.57 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.624 0.726 . . . . 0.0 109.042 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.505 HD11 HD13 ' A' ' 28' ' ' LEU . 45.2 mt -101.0 148.35 7.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 167.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -115.56 162.02 17.8 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.668 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 24.6 t -138.41 103.92 2.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.1 m95 . . . . . 0 N--CA 1.471 0.578 0 C-N-CA 123.238 0.615 . . . . 0.0 110.206 -174.865 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -117.3 151.84 36.12 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.09 1.356 . . . . 0.0 108.729 -174.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -99.19 103.96 15.88 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.531 HD12 ' HB3' ' A' ' 91' ' ' ASP . 2.2 mm? -100.56 127.91 46.78 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.511 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 93.1 mtt180 -92.5 105.14 17.37 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.164 0.586 . . . . 0.0 110.25 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -99.37 118.24 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.155 -172.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.456 ' NE2' HD11 ' A' ' 92' ' ' LEU . 26.7 mt-30 -125.6 128.26 47.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.013 0.525 . . . . 0.0 110.58 -170.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.686 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.346 1.103 0 O-C-N 123.58 0.55 . . . . 0.0 113.625 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.407 HG23 ' HG2' ' A' ' 31' ' ' GLN . 86.9 m . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.1 tp -130.64 152.34 50.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.511 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.7 pt-20 -133.04 132.29 41.65 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 164.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -134.25 148.57 29.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 123.779 0.832 . . . . 0.0 109.662 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 m -92.08 109.4 20.76 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.275 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HB3' HD23 ' A' ' 28' ' ' LEU . 56.7 tp -105.75 133.08 51.06 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.925 177.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -77.44 146.64 36.4 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 15.0 ptm180 -66.57 -20.76 66.09 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.324 0.65 . . . . 0.0 112.161 -174.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.75 -18.51 22.84 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.399 1.08 . . . . 0.0 110.899 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.0 m -93.5 126.1 51.43 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 123.712 0.805 . . . . 0.0 109.542 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.48 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 9.9 Cg_endo -65.98 164.41 27.45 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.138 1.892 . . . . 0.0 113.826 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.472 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -59.94 -25.92 65.55 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.106 -177.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 65.0 pttt -57.34 -38.03 73.47 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.3 t -70.45 -31.31 68.42 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 117.819 0.281 . . . . 0.0 110.53 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -69.47 -42.12 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.231 1.012 . . . . 0.0 110.276 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -56.96 -44.89 83.05 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.424 1.089 . . . . 0.0 110.505 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.8 m -67.56 -39.14 84.93 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 113.89 -1.505 . . . . 0.0 110.134 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -65.17 -45.87 83.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.968 0.507 . . . . 0.0 110.164 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -55.9 -60.36 3.58 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.78 1.232 . . . . 0.0 111.722 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.77 -38.09 86.72 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.584 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -65.9 -35.32 80.31 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 121.868 -0.52 . . . . 0.0 111.89 175.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.238 0 C-N-CA 123.461 0.704 . . . . 0.0 112.798 -177.833 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.409 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.446 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.0 m -87.11 159.89 18.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.377 0.671 . . . . 0.0 111.241 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.83 129.14 40.06 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -128.87 143.1 50.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.03 0.932 . . . . 0.0 111.69 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.576 ' HB3' HD21 ' A' ' 76' ' ' LEU . 16.2 t80 -133.67 104.32 6.29 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.914 1.685 . . . . 0.0 107.845 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t70 55.18 30.45 14.54 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 122.519 1.152 . . . . 0.0 111.841 -174.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 88.3 -3.66 85.42 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 114.94 -1.027 . . . . 0.0 113.679 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.0 m -75.54 113.94 13.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.442 0.697 . . . . 0.0 109.596 174.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -66.88 113.59 5.05 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 173.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 71' ' ' PHE . 38.8 mt -78.94 112.19 15.88 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.252 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.0 m -78.95 -26.65 43.56 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.94 0.896 . . . . 0.0 112.672 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.04 -45.73 1.1 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.618 -178.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.16 4.83 44.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 111.431 -164.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.2 pm0 -91.75 147.99 22.58 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.5 mt -98.2 156.21 36.09 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 125.71 1.604 . . . . 0.0 109.108 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.565 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 54.6 Cg_endo -66.76 -23.95 47.79 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 121.546 1.498 . . . . 0.0 111.485 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 -37.52 68.81 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.677 0.791 . . . . 0.0 111.188 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -62.63 -42.47 99.61 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.805 0.842 . . . . 0.0 110.48 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.505 HD21 ' HG3' ' A' ' 80' ' ' GLU . 76.8 mt -79.25 -24.0 43.3 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.81 0.844 . . . . 0.0 111.348 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 73.64 64.8 2.38 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 -175.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 70.2 mtp -106.87 170.85 7.7 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.9 0.88 . . . . 0.0 110.391 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.454 ' H ' ' HB2' ' A' ' 91' ' ' ASP . 39.1 tt0 -126.83 169.51 13.15 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.958 0.903 . . . . 0.0 109.954 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -75.1 11.78 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.787 0.835 . . . . 0.0 112.503 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -148.58 46.77 0.67 Allowed Glycine 0 C--N 1.34 0.797 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.531 ' HB3' HD12 ' A' ' 28' ' ' LEU . 7.2 t70 -93.04 176.64 6.34 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.456 HD11 ' NE2' ' A' ' 31' ' ' GLN . 28.6 tp -131.4 118.88 20.87 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -172.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 44.6 mt -106.63 147.24 12.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 170.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -124.54 155.67 38.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -175.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.686 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 11.6 t -135.12 126.76 46.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 123.343 0.657 . . . . 0.0 109.242 -171.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.8 m95 . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 124.246 1.018 . . . . 0.0 109.395 -174.399 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.529 ' NE2' ' HB2' ' A' ' 42' ' ' SER . 19.4 pt20 . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 121.146 0.498 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' A' ' 82' ' ' PRO . 57.5 mt -110.59 135.11 51.73 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.778 1.231 . . . . 0.0 108.577 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -90.8 103.84 16.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 35.3 mt -109.65 132.97 53.65 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.185 -0.322 . . . . 0.0 110.329 -171.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -95.2 140.68 29.78 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -129.7 132.37 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -173.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -135.84 141.94 44.74 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.065 0.393 . . . . 0.0 110.866 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.687 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.347 1.141 0 O-C-N 123.683 0.615 . . . . 0.0 113.306 177.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 120.694 0.283 . . . . 0.0 110.77 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.57 121.16 18.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.33 1.052 . . . . 0.0 108.204 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -105.11 116.23 31.59 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -123.6 144.95 31.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 123.992 0.917 . . . . 0.0 110.251 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.529 ' HB2' ' NE2' ' A' ' 25' ' ' GLN . 25.8 p -91.19 110.02 21.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 44.6 tp -109.59 134.16 52.26 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.735 0.814 . . . . 0.0 108.813 177.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 57.4 m -73.57 142.77 46.62 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 176.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.542 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 35.5 ptt180 -62.49 -27.64 69.28 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.2 0.6 . . . . 0.0 112.13 -173.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -95.92 -9.94 30.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.729 0.811 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 44' ' ' SER . 66.4 m -90.13 139.67 27.24 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 123.681 0.793 . . . . 0.0 109.443 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.59 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 7.2 Cg_exo -65.88 157.45 59.06 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.872 2.381 . . . . 0.0 113.093 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.6 mm? -58.11 -27.8 64.06 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.519 173.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.59 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 61.2 pttt -58.09 -38.07 75.7 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.604 0.638 . . . . 0.0 112.608 -177.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.473 HG22 ' O ' ' A' ' 48' ' ' PRO . 13.2 t -72.49 -29.39 63.6 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 120.817 0.341 . . . . 0.0 110.454 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 tt -69.72 -42.52 73.9 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.885 0.874 . . . . 0.0 110.099 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.5 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -56.9 -46.86 81.64 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.344 1.058 . . . . 0.0 110.51 177.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.7 t -64.36 -35.57 81.32 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.404 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -68.7 -46.32 69.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.381 0.672 . . . . 0.0 110.216 -178.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -57.39 -60.15 4.08 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.359 1.064 . . . . 0.0 111.823 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.15 -32.81 73.46 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.84 0.712 . . . . 0.0 111.787 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -73.44 -38.54 65.48 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 C-N-CA 123.724 0.81 . . . . 0.0 112.669 -175.335 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.422 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.767 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.483 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 21.3 m -86.57 162.32 18.07 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.406 0.683 . . . . 0.0 111.243 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -131.22 126.76 36.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.394 1.078 . . . . 0.0 109.152 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.431 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 9.6 m-85 -123.44 151.29 42.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.618 0.767 . . . . 0.0 110.762 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.577 ' HB3' HD21 ' A' ' 76' ' ' LEU . 22.2 t80 -137.25 114.11 10.52 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 172.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.8 25.68 15.21 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.794 0.838 . . . . 0.0 110.824 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 78.03 4.46 86.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.561 -174.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.0 m -82.82 120.2 25.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.785 0.834 . . . . 0.0 109.066 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tmtp? -68.12 115.29 7.44 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.577 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.4 mt -81.97 112.06 18.71 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.0 t -71.87 -34.22 69.03 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.767 0.827 . . . . 0.0 111.979 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.86 -9.43 11.43 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 116.009 -0.541 . . . . 0.0 113.356 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -109.82 10.97 24.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.514 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.4 pm0 -101.74 147.92 25.89 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -98.86 156.26 35.74 Favored Pre-proline 0 C--N 1.312 -1.023 0 C-N-CA 125.183 1.393 . . . . 0.0 108.683 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.542 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 49.4 Cg_endo -65.38 -33.02 49.15 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.799 1.666 . . . . 0.0 111.072 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.16 79.64 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.848 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.49 -42.93 77.95 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.935 0.894 . . . . 0.0 111.683 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.514 HD21 ' HG3' ' A' ' 80' ' ' GLU . 85.0 mt -70.95 -22.98 62.15 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.447 0.699 . . . . 0.0 111.293 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 99.06 17.67 26.79 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.724 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.3 mtt -71.06 166.9 20.41 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.777 0.831 . . . . 0.0 111.627 177.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -166.19 2.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.197 0.999 . . . . 0.0 109.67 175.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.7 m -78.64 12.83 1.87 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -165.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -162.09 63.23 0.27 Allowed Glycine 0 C--N 1.352 1.426 0 CA-C-N 118.245 0.475 . . . . 0.0 112.22 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.44 -168.65 1.72 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.693 0.397 . . . . 0.0 110.038 -170.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.3 tp -139.83 127.5 21.78 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.827 0.851 . . . . 0.0 109.23 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.4 mt -121.2 152.63 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.935 1.294 . . . . 0.0 108.448 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.431 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 30.8 mt-10 -114.04 160.73 18.56 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.793 1.237 . . . . 0.0 107.899 -173.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.687 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 9.4 t -137.26 107.88 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.85 0.86 . . . . 0.0 109.034 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.2 m0 . . . . . 0 CA--C 1.541 0.622 0 C-N-CA 124.218 1.007 . . . . 0.0 108.656 -176.936 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.516 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 4.3 pp0? . . . . . 0 C--O 1.24 0.563 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.405 HD22 ' HB2' ' A' ' 82' ' ' PRO . 6.6 mp -102.73 125.21 49.38 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.149 1.38 . . . . 0.0 109.437 -166.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -80.07 100.53 8.24 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 176.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.7 mt -114.13 128.86 56.57 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.767 0.427 . . . . 0.0 110.049 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -95.33 132.05 40.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -123.17 129.42 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -174.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -129.55 130.59 45.95 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.613 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.346 1.11 0 O-C-N 123.368 0.417 . . . . 0.0 113.335 -177.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m . . . . . 0 C--O 1.236 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -128.0 113.53 15.95 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 -170.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -106.74 121.98 45.45 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -172.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -132.01 147.11 32.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.854 0.862 . . . . 0.0 110.832 -171.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.8 m -90.9 111.62 23.13 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.248 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.492 HD21 HD22 ' A' ' 49' ' ' LEU . 29.2 tp -114.62 121.24 42.81 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.254 0.621 . . . . 0.0 109.523 175.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 21.3 m -75.16 149.13 39.09 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.559 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 30.6 ptt180 -69.94 -13.47 62.26 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -99.42 -19.62 16.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.498 0.719 . . . . 0.0 109.665 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.44 ' HB3' HG21 ' A' ' 51' ' ' THR . 58.0 m -85.54 133.4 42.15 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.197 0.999 . . . . 0.0 109.597 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.467 ' O ' HG22 ' A' ' 51' ' ' THR . 3.3 Cg_exo -71.77 159.42 50.75 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.492 HD22 HD21 ' A' ' 43' ' ' LEU . 2.7 mm? -53.85 -30.69 46.66 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.06 1.344 . . . . 0.0 111.774 177.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -39.76 58.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.007 0.923 . . . . 0.0 112.935 177.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.467 HG22 ' O ' ' A' ' 48' ' ' PRO . 2.5 t -69.72 -33.12 72.04 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 120.87 0.367 . . . . 0.0 110.888 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.85 -38.68 73.17 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.254 1.021 . . . . 0.0 110.455 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.482 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -59.01 -42.77 90.93 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.818 0.847 . . . . 0.0 110.192 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -61.62 -42.51 98.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.709 1.256 . . . . 0.0 110.827 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -68.96 -44.73 72.37 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.316 0.647 . . . . 0.0 110.922 -174.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -58.13 -54.05 51.35 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.304 1.042 . . . . 0.0 111.61 176.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.59 -41.62 96.13 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.593 0.558 . . . . 0.0 110.641 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -57.56 -44.37 85.21 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.765 0.426 . . . . 0.0 111.657 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.387 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.483 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.1 m -83.22 156.79 22.98 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.85 0.86 . . . . 0.0 111.209 -176.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 36.1 m-85 -125.51 128.95 48.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.678 1.191 . . . . 0.0 108.84 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -131.35 139.41 49.51 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.65 0.78 . . . . 0.0 111.033 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -131.59 111.72 11.97 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.429 1.492 . . . . 0.0 108.266 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 53.88 30.36 11.39 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.801 1.241 . . . . 0.0 112.044 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 92.07 -19.01 51.96 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.712 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.2 m -70.79 137.69 49.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.932 0.893 . . . . 0.0 110.665 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -89.41 117.24 28.19 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.41 109.34 13.68 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -79.24 -28.83 42.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.641 0.776 . . . . 0.0 111.457 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.65 -52.04 0.66 Allowed Glycine 0 C--N 1.348 1.201 0 C-N-CA 122.994 0.33 . . . . 0.0 113.327 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.0 mtp-105 -85.6 2.12 46.35 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.916 0.886 . . . . 0.0 113.315 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.556 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.1 pm0 -85.71 148.82 25.69 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 38.5 mt -100.4 151.35 37.53 Favored Pre-proline 0 C--N 1.316 -0.885 0 C-N-CA 124.957 1.303 . . . . 0.0 108.614 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.559 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 57.5 Cg_endo -65.51 -35.05 40.42 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 121.966 1.777 . . . . 0.0 111.232 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . . . -60.26 -33.84 72.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.971 0.909 . . . . 0.0 111.151 173.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -73.8 -44.67 55.17 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.539 0.735 . . . . 0.0 110.72 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.556 HD21 ' HG3' ' A' ' 80' ' ' GLU . 26.5 mt -66.9 -24.53 66.12 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.217 0.607 . . . . 0.0 110.817 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 88.77 51.79 2.96 Favored Glycine 0 C--N 1.345 1.079 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -175.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.2 mtp -112.82 165.33 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.408 1.083 . . . . 0.0 109.946 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.403 ' HG2' ' N ' ' A' ' 89' ' ' SER . 31.1 tt0 -153.6 166.45 32.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.142 0.977 . . . . 0.0 108.839 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.403 ' N ' ' HG2' ' A' ' 88' ' ' GLU . 33.3 m -54.59 111.8 0.88 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.568 0.747 . . . . 0.0 110.052 173.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.98 -28.79 3.3 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.045 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.48 168.21 1.66 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.8 tp -130.26 109.04 10.47 Favored 'General case' 0 C--N 1.349 0.555 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -168.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.7 mt -92.06 152.2 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 171.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -124.06 165.16 17.97 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 -178.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.613 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 14.8 t -137.06 133.61 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 93.8 m95 . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 124.319 1.048 . . . . 0.0 108.745 -170.901 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.577 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 3.2 pp0? . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.408 0.623 . . . . 0.0 109.803 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -116.06 150.41 37.34 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.03 1.332 . . . . 0.0 107.504 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -99.82 103.32 14.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.568 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.8 mm? -101.16 126.97 47.91 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -91.48 105.28 17.65 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.387 0.675 . . . . 0.0 109.768 -176.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.33 123.82 52.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.041 0.937 . . . . 0.0 108.695 -173.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -130.69 138.19 49.91 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.816 0.446 . . . . 0.0 110.491 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.645 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.347 1.154 0 O-C-N 123.684 0.615 . . . . 0.0 113.185 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.4 m . . . . . 0 C--O 1.237 0.417 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.5 tp -131.97 154.35 49.4 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 173.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.1 132.53 44.91 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 167.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -131.0 146.39 34.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 123.613 0.765 . . . . 0.0 109.521 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.3 p -90.86 105.94 18.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.568 ' HB3' HD23 ' A' ' 28' ' ' LEU . 66.6 tp -107.34 130.72 54.75 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.919 176.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.577 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 41.9 t -75.62 152.32 37.65 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.654 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 31.6 ptt180 -69.13 -13.38 62.39 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.479 0.712 . . . . 0.0 111.746 179.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -99.13 -23.67 15.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.919 0.888 . . . . 0.0 109.882 177.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 133.04 50.88 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.63 0.772 . . . . 0.0 110.305 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.48 ' O ' HG22 ' A' ' 51' ' ' THR . 6.1 Cg_exo -69.64 158.6 56.54 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.833 2.355 . . . . 0.0 113.271 178.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.3 mm? -58.35 -25.79 62.38 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.742 1.217 . . . . 0.0 112.04 177.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.51 -39.16 75.9 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.223 0.609 . . . . 0.0 112.387 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -72.38 -29.53 63.85 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 120.897 0.38 . . . . 0.0 110.778 -178.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -70.39 -41.45 72.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.037 0.935 . . . . 0.0 110.314 172.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 63.8 mtt -55.02 -49.72 70.85 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.994 0.918 . . . . 0.0 110.835 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 p -67.06 -38.35 85.65 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.972 1.42 . . . . 0.0 109.627 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -64.64 -48.79 73.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.024 0.53 . . . . 0.0 110.288 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -56.29 -59.08 5.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.088 0.955 . . . . 0.0 111.837 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -62.31 -31.64 72.28 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.027 0.83 . . . . 0.0 112.55 -175.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -70.72 -46.42 63.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.434 0.294 . . . . 0.0 111.789 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.196 0 C-N-CA 123.55 0.74 . . . . 0.0 112.451 -173.602 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.458 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.058 0.456 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 160.27 14.76 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.289 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -124.68 131.79 53.44 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.011 0.924 . . . . 0.0 109.37 -177.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -134.06 116.92 16.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.388 1.075 . . . . 0.0 110.534 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.428 ' HB3' HD11 ' A' ' 76' ' ' LEU . 2.3 t80 -97.41 109.76 22.45 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.6 t70 51.8 40.57 28.01 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.052 0.93 . . . . 0.0 111.02 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 72.71 6.27 66.42 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 114.982 -1.008 . . . . 0.0 114.575 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -87.84 116.99 26.38 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.97 0.908 . . . . 0.0 109.57 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -67.16 113.84 5.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.425 0.453 . . . . 0.0 110.232 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.428 HD11 ' HB3' ' A' ' 71' ' ' PHE . 1.1 mm? -80.65 123.69 28.37 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.7 m -75.09 -30.12 60.82 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.768 0.827 . . . . 0.0 110.716 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.91 -38.32 2.27 Favored Glycine 0 C--N 1.345 1.034 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.219 -175.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -87.55 2.56 50.44 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -170.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -89.54 147.71 23.8 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 172.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.2 mt -97.21 158.08 33.84 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 125.119 1.368 . . . . 0.0 108.261 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.654 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 62.0 Cg_endo -66.29 -27.56 47.95 Favored 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 110.781 176.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.69 -37.12 81.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.594 0.757 . . . . 0.0 110.707 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -68.65 -41.33 79.5 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.789 0.835 . . . . 0.0 110.647 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.536 HD21 ' HG3' ' A' ' 80' ' ' GLU . 84.5 mt -75.54 -24.12 56.7 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.074 0.95 . . . . 0.0 112.17 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.99 58.56 3.18 Favored Glycine 0 C--N 1.346 1.091 0 O-C-N 123.371 0.419 . . . . 0.0 112.22 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.8 mtp -102.83 171.0 7.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.115 0.966 . . . . 0.0 110.079 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.4 tt0 -137.23 157.57 46.35 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.068 0.547 . . . . 0.0 110.876 -178.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.3 p -59.28 111.1 1.23 Allowed 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 168.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 94.8 42.23 3.9 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.889 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.536 ' HB3' HD12 ' A' ' 28' ' ' LEU . 2.4 t70 -97.53 -171.57 2.22 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 177.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 35.7 tp -137.03 135.48 37.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.261 0.625 . . . . 0.0 109.5 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.4 mt -127.34 148.92 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.66 154.36 39.48 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -173.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.645 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.8 t -133.7 121.93 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.3 m95 . . . . . 0 C--O 1.236 0.368 0 C-N-CA 124.407 1.083 . . . . 0.0 109.566 -172.923 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.433 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.426 0 CA-C-O 121.812 0.815 . . . . 0.0 111.563 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -116.77 151.01 37.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.698 1.599 . . . . 0.0 109.323 -177.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -103.06 109.78 21.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 171.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.513 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.1 mm? -112.24 139.63 47.62 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.3 mtp85 -92.76 112.83 24.93 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.493 0.717 . . . . 0.0 110.546 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.28 113.5 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.499 1.12 . . . . 0.0 108.665 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -126.29 133.59 51.37 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -172.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.578 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.873 0 O-C-N 123.718 0.636 . . . . 0.0 112.556 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.3 m . . . . . 0 C--O 1.237 0.439 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -139.85 142.38 36.59 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -133.71 136.61 44.77 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -140.2 151.71 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 123.919 0.887 . . . . 0.0 109.989 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -92.13 108.67 20.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.424 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.513 ' HB3' HD23 ' A' ' 28' ' ' LEU . 31.2 tp -105.21 131.47 52.64 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.531 1.132 . . . . 0.0 109.178 175.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 44.7 m -76.84 151.65 35.79 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.514 0.509 . . . . 0.0 109.654 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.595 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 12.8 ptm180 -67.53 -18.69 65.12 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.257 0.551 . . . . 0.0 110.949 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -92.92 -30.93 15.14 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.138 1.375 . . . . 0.0 109.77 -175.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.414 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 50.6 m -88.34 140.63 30.34 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.21 1.004 . . . . 0.0 110.35 -176.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.506 ' O ' HG22 ' A' ' 51' ' ' THR . 6.8 Cg_exo -67.78 157.66 60.76 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.221 2.614 . . . . 0.0 113.408 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -51.79 -32.35 30.88 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.061 1.344 . . . . 0.0 112.068 173.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.466 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -58.88 -35.88 73.72 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.638 0.775 . . . . 0.0 112.593 -177.351 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.506 HG22 ' O ' ' A' ' 48' ' ' PRO . 4.3 t -67.7 -33.69 75.39 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.93 -40.78 68.52 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.532 1.133 . . . . 0.0 110.607 175.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.9 mtt -58.83 -46.33 87.92 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.072 0.949 . . . . 0.0 110.865 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 p -68.18 -28.06 66.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.48 1.112 . . . . 0.0 110.799 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -71.31 -47.7 55.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.323 0.649 . . . . 0.0 110.322 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.26 -58.83 5.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.38 1.072 . . . . 0.0 111.905 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 53' ' ' MET . 6.7 pt-20 -59.52 -31.04 69.02 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 124.018 0.823 . . . . 0.0 112.427 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.47 -43.06 70.56 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -174.968 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.466 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -93.3 158.69 15.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.424 0.69 . . . . 0.0 110.732 -175.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 48.1 m-85 -124.32 127.83 48.21 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.432 1.093 . . . . 0.0 109.375 -176.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.25 129.76 49.57 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.082 0.953 . . . . 0.0 110.195 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.494 ' HB3' HD21 ' A' ' 76' ' ' LEU . 51.6 t80 -108.02 109.41 20.86 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.77 27.08 16.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.557 1.143 . . . . 0.0 111.391 -172.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.55 -2.11 88.26 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.055 -0.521 . . . . 0.0 113.852 -175.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.8 m -79.01 122.56 26.34 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -67.87 117.64 10.02 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 71' ' ' PHE . 21.5 mt -92.29 120.34 32.74 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.2 t -77.47 -23.02 50.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.264 0.626 . . . . 0.0 110.965 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.99 -38.64 2.99 Favored Glycine 0 C--N 1.344 0.991 0 C-N-CA 123.043 0.354 . . . . 0.0 113.286 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.7 mtp180 -76.41 -14.98 60.04 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.558 0.743 . . . . 0.0 112.849 -171.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.24 149.02 44.94 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 173.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 48' ' ' PRO . 21.8 mt -99.13 157.21 34.46 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 125.161 1.384 . . . . 0.0 107.302 176.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.595 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.1 Cg_endo -65.54 -17.02 56.3 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 121.466 1.444 . . . . 0.0 111.39 178.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.78 93.38 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.747 0.819 . . . . 0.0 111.006 170.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -68.01 -45.62 73.54 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.107 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.514 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 79.5 mt -74.24 -15.0 61.01 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.616 0.766 . . . . 0.0 112.561 -176.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.67 35.73 27.86 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.153 0.283 . . . . 0.0 112.991 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.514 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 60.5 mtp -90.22 166.4 13.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.169 0.988 . . . . 0.0 110.855 -177.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -153.81 166.38 33.07 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.3 t -61.51 112.05 2.05 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.888 0.475 . . . . 0.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 130.5 -27.63 3.92 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.814 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.451 ' HB2' HD12 ' A' ' 28' ' ' LEU . 1.8 m-20 -58.08 172.72 0.4 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.2 tp -133.83 113.94 12.8 Favored 'General case' 0 C--N 1.352 0.682 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.393 -163.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.411 HD11 ' HE1' ' A' ' 87' ' ' MET . 39.4 mt -100.39 149.17 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 172.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 69' ' ' PHE . 36.5 mt-10 -112.96 158.38 20.31 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -172.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.578 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.1 t -135.15 118.73 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.1 m95 . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 125.277 1.431 . . . . 0.0 109.033 -178.965 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 121.032 0.444 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 82.8 mt -91.55 129.67 37.5 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.587 -174.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -89.17 102.73 15.38 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.636 HD23 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mm? -106.19 122.02 45.35 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -89.79 124.36 34.59 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.328 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.83 117.17 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.223 1.009 . . . . 0.0 109.54 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -127.01 130.92 50.96 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.965 0.906 . . . . 0.0 108.579 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.485 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.339 0.698 0 O-C-N 123.753 0.658 . . . . 0.0 113.596 -173.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.241 0.627 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -131.2 137.47 48.97 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -132.01 141.57 49.3 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.056 0.455 . . . . 0.0 109.878 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.33 152.6 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.119 0.968 . . . . 0.0 109.84 178.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -91.71 110.78 22.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.636 ' HB3' HD23 ' A' ' 28' ' ' LEU . 32.2 tp -102.85 136.66 42.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.465 0.706 . . . . 0.0 109.824 176.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 34.0 t -76.29 143.88 40.62 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.582 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.1 ptm180 -60.58 -29.41 69.17 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.986 0.914 . . . . 0.0 112.835 -175.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -110.57 3.06 19.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.532 0.733 . . . . 0.0 111.977 -178.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 70.1 m -93.47 134.04 27.33 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 170.385 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.567 ' O ' HG22 ' A' ' 51' ' ' THR . 2.8 Cg_exo -65.95 155.69 68.21 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.753 2.302 . . . . 0.0 112.784 -176.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -53.54 -27.53 26.54 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.982 1.313 . . . . 0.0 112.322 176.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.69 -37.98 74.39 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.759 0.824 . . . . 0.0 112.949 179.555 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.3 t -67.3 -33.31 75.02 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.348 0.594 . . . . 0.0 110.359 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.36 -41.06 66.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.961 1.304 . . . . 0.0 110.442 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.2 mtt -55.05 -44.03 74.34 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.93 0.892 . . . . 0.0 110.915 176.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -67.26 -35.38 79.39 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -71.53 -46.76 58.7 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.909 0.484 . . . . 0.0 110.777 -175.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -54.09 -57.46 11.0 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.811 0.845 . . . . 0.0 111.743 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.7 pt-20 -60.1 -31.83 70.41 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.894 0.746 . . . . 0.0 111.768 -177.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.51 -36.75 76.75 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 173.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -178.214 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.517 HD23 ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 121.209 0.528 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 31.8 m -113.32 156.57 23.14 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.306 1.042 . . . . 0.0 109.803 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.517 ' CE1' HD23 ' A' ' 67' ' ' LEU . 38.9 m-85 -122.61 128.2 50.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.659 0.784 . . . . 0.0 110.041 -172.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 60.7 m-85 -127.44 139.32 52.9 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.868 0.867 . . . . 0.0 110.783 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -116.24 107.08 14.41 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 51.19 41.42 27.73 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 122.093 0.949 . . . . 0.0 111.244 -172.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.55 -8.22 66.02 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 115.032 -0.985 . . . . 0.0 114.949 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.8 m -74.51 115.58 14.21 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.225 0.61 . . . . 0.0 109.719 178.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.48 114.06 4.59 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.01 109.12 16.06 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.6 m -69.48 -28.11 65.79 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.089 0.955 . . . . 0.0 111.005 -176.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.52 -49.5 0.9 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.385 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -87.42 10.83 16.22 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.628 0.771 . . . . 0.0 112.967 -170.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 mp0 -83.87 148.13 27.14 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 173.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 30.3 mt -101.26 152.05 37.86 Favored Pre-proline 0 C--N 1.309 -1.182 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 176.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.582 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 59.1 Cg_endo -64.36 -35.66 49.14 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.687 1.591 . . . . 0.0 110.989 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.52 -30.55 70.25 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.164 0.586 . . . . 0.0 110.8 175.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -71.87 -45.16 62.31 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.805 0.842 . . . . 0.0 111.592 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.425 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 54.6 mt -69.91 -24.94 63.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.49 0.716 . . . . 0.0 111.487 -176.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.0 45.92 3.48 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 -173.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.425 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 63.3 mtp -104.76 163.97 12.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.158 0.983 . . . . 0.0 108.99 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.415 ' HG2' ' H ' ' A' ' 89' ' ' SER . 38.4 tt0 -135.07 178.37 7.08 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 -176.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.415 ' H ' ' HG2' ' A' ' 88' ' ' GLU . 30.0 p -74.19 19.22 0.13 Allowed 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -176.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.09 61.14 0.3 Allowed Glycine 0 C--N 1.344 0.985 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 172.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.485 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -111.12 -177.49 3.22 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.568 0.747 . . . . 0.0 109.399 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 37.6 tp -137.52 114.78 10.94 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 109.913 -167.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 43.1 mt -98.11 150.91 4.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 113.956 -1.474 . . . . 0.0 108.563 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 41.9 mt-10 -106.14 152.86 22.89 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 -175.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.485 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.6 t -130.63 109.44 16.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 92.1 m95 . . . . . 0 CA--C 1.533 0.293 0 C-N-CA 124.156 0.982 . . . . 0.0 109.835 -174.617 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 40.4 mt-30 . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 82' ' ' PRO . 56.2 mt -107.84 129.27 55.08 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.187 1.395 . . . . 0.0 109.173 -177.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -84.25 103.12 13.18 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -112.27 132.49 54.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.034 0.534 . . . . 0.0 110.336 -175.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -91.2 110.59 21.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.169 0.987 . . . . 0.0 109.021 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HE2' ' A' ' 69' ' ' PHE . 2.2 t -105.78 124.72 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -177.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -135.5 145.14 46.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 118.099 0.409 . . . . 0.0 110.359 -173.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.557 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.348 1.225 0 O-C-N 123.374 0.421 . . . . 0.0 112.538 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 m . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 120.858 0.361 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 56' ' ' TYR . 15.2 tp -138.3 127.39 24.16 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 167.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -103.17 113.03 26.18 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 175.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.95 151.17 23.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 123.828 0.851 . . . . 0.0 110.435 -172.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -92.49 109.23 20.62 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 171.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.433 ' HB2' HD12 ' A' ' 52' ' ' LEU . 23.6 tp -105.82 125.53 51.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.25 0.62 . . . . 0.0 109.381 172.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 58.6 m -73.18 144.34 46.87 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.525 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 26.4 ptt180 -62.54 -26.51 68.61 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.876 0.87 . . . . 0.0 112.398 -173.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -99.56 -11.7 20.78 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.783 0.833 . . . . 0.0 111.029 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 50.4 m -92.34 136.77 25.19 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 123.743 0.817 . . . . 0.0 109.381 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.551 ' O ' HG22 ' A' ' 51' ' ' THR . 3.7 Cg_exo -71.41 161.69 44.75 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.796 2.331 . . . . 0.0 113.781 -176.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.558 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.8 mm? -53.83 -31.4 49.14 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 125.241 1.416 . . . . 0.0 112.242 175.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -32.71 72.42 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.551 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -70.18 -33.26 71.51 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 118.113 0.415 . . . . 0.0 111.036 174.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.433 HD12 ' HB2' ' A' ' 43' ' ' LEU . 6.3 tt -68.94 -39.31 79.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.1 0.96 . . . . 0.0 110.126 173.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.3 mtt -59.01 -42.73 90.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.327 1.051 . . . . 0.0 110.09 175.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 t -68.02 -40.28 82.97 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.259 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -66.63 -48.2 70.2 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 120.952 0.406 . . . . 0.0 110.569 -174.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.417 ' HA ' HD22 ' A' ' 39' ' ' LEU . 50.4 t80 -55.18 -53.46 55.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.005 1.322 . . . . 0.0 112.213 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.83 -46.62 84.26 Favored 'General case' 0 CA--C 1.558 1.253 0 O-C-N 124.154 0.908 . . . . 0.0 110.908 -179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.38 -45.54 84.36 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.241 0.616 . . . . 0.0 111.994 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.079 0 C-N-CA 124.074 0.95 . . . . 0.0 112.935 -178.087 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.593 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 21.1 m -76.95 144.46 38.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.407 0.283 . . . . 0.0 110.892 -174.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.451 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 49.2 m-85 -120.26 125.85 49.13 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.894 0.877 . . . . 0.0 109.892 179.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -125.13 133.08 52.97 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.266 1.026 . . . . 0.0 110.094 177.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.447 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.1 t80 -124.46 114.56 19.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.219 1.008 . . . . 0.0 108.538 174.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.14 27.83 15.58 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.593 1.157 . . . . 0.0 111.368 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.84 -8.17 76.98 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.314 -0.857 . . . . 0.0 113.828 -177.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 96.7 m -73.76 119.86 18.56 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.114 0.566 . . . . 0.0 110.272 176.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -68.07 113.5 5.79 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.447 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.3 mt -82.03 116.84 21.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.7 m -73.37 -31.65 64.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.656 0.782 . . . . 0.0 111.155 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.8 -48.65 0.96 Allowed Glycine 0 C--N 1.343 0.923 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.296 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.5 mtp85 -86.45 9.72 17.34 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -169.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -84.66 147.54 26.89 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 166.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.16 161.96 26.41 Favored Pre-proline 0 C--N 1.313 -0.981 0 C-N-CA 124.541 1.136 . . . . 0.0 108.566 174.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.525 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 60.8 Cg_endo -66.23 -30.29 46.07 Favored 'Trans proline' 0 C--N 1.368 1.581 0 C-N-CA 121.429 1.419 . . . . 0.0 110.812 174.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.4 80.12 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.053 0.941 . . . . 0.0 111.032 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -69.54 -48.78 59.25 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.016 0.927 . . . . 0.0 111.841 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.426 HD12 ' HE2' ' A' ' 87' ' ' MET . 87.9 mt -71.83 -20.8 61.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.433 0.693 . . . . 0.0 111.397 -177.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.92 15.66 51.29 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.455 0.472 . . . . 0.0 112.456 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.558 ' HE1' HD11 ' A' ' 49' ' ' LEU . 57.9 mtm -76.54 160.09 29.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.326 0.65 . . . . 0.0 110.869 177.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -160.82 166.64 28.24 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.712 1.205 . . . . 0.0 107.981 -170.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.1 m -61.04 106.08 0.55 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 118.029 0.377 . . . . 0.0 110.519 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 136.56 -32.73 2.43 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.032 -0.531 . . . . 0.0 113.219 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.7 170.81 0.07 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.4 tp -132.16 109.28 9.85 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -168.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 51.6 mt -95.94 147.96 5.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.567 -1.272 . . . . 0.0 107.567 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -124.06 161.76 24.89 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -172.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.557 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.7 t -140.06 128.04 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.844 0.858 . . . . 0.0 110.418 -169.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.593 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 55.9 m95 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.5 mp -110.23 147.95 32.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.23 1.412 . . . . 0.0 108.431 -172.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -102.14 104.73 15.35 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.547 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.9 mm? -104.65 135.85 45.28 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -175.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -90.59 128.94 36.75 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.94 123.21 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -172.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -134.01 141.06 47.09 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.016 0.371 . . . . 0.0 110.564 -173.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.666 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 C--N 1.342 0.894 0 O-C-N 123.871 0.732 . . . . 0.0 112.323 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.0 m . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 121.143 0.497 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.3 tp -136.3 136.29 39.63 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -119.54 122.85 42.55 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.0 p -128.76 149.45 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 123.935 0.894 . . . . 0.0 110.562 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 p -92.93 108.94 20.39 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 28' ' ' LEU . 28.1 tp -103.91 134.33 47.38 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.456 1.102 . . . . 0.0 109.494 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.9 t -79.0 145.72 33.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.627 ' HB2' ' HB2' ' A' ' 83' ' ' ALA . 33.6 ptt180 -68.41 -13.51 62.35 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.753 0.421 . . . . 0.0 112.041 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -97.65 -21.71 16.88 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.115 0.966 . . . . 0.0 109.91 177.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.6 m -88.38 134.75 33.85 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.509 ' O ' HG22 ' A' ' 51' ' ' THR . 5.4 Cg_exo -71.11 163.39 39.36 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 122.71 2.273 . . . . 0.0 112.968 178.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 53' ' ' MET . 2.6 mm? -60.65 -22.94 64.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.479 1.112 . . . . 0.0 111.655 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.43 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -56.94 -38.29 72.72 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.302 0.641 . . . . 0.0 112.166 178.52 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.6 t -71.0 -28.77 64.66 Favored 'General case' 0 C--N 1.355 0.84 0 CA-C-O 120.862 0.363 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -74.58 -41.11 61.08 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 110.359 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -55.43 -48.93 73.68 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.785 0.834 . . . . 0.0 111.051 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.7 p -70.41 -33.63 71.58 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 113.868 -1.515 . . . . 0.0 109.61 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.11 -52.7 46.25 Favored 'General case' 0 C--N 1.354 0.787 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -55.84 -60.7 3.09 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 123.829 0.852 . . . . 0.0 111.506 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.43 -38.11 79.81 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.792 0.682 . . . . 0.0 112.749 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.66 -29.07 61.11 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.215 0 C-N-CA 123.087 0.555 . . . . 0.0 111.804 -179.439 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.471 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 121.077 0.465 . . . . 0.0 110.998 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.1 m -91.58 163.51 14.1 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.99 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 35.4 m-85 -129.02 130.45 46.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.319 1.048 . . . . 0.0 108.968 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -130.44 129.02 42.46 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.726 0.81 . . . . 0.0 111.485 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -119.2 111.99 18.93 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.632 1.573 . . . . 0.0 107.673 172.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 51.56 40.69 27.61 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.065 0.936 . . . . 0.0 112.011 -177.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 81.54 -19.28 9.14 Favored Glycine 0 N--CA 1.478 1.457 0 CA-C-N 115.012 -0.994 . . . . 0.0 114.589 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.7 m -71.23 116.03 11.07 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.458 0.703 . . . . 0.0 109.919 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -70.87 113.69 8.18 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.33 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.22 116.23 13.51 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 m -74.06 -35.68 64.29 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.153 0.981 . . . . 0.0 111.886 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.15 -56.25 0.51 Allowed Glycine 0 C--N 1.347 1.165 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.925 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -89.77 10.29 24.06 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -167.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.512 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.9 OUTLIER -86.43 148.46 25.55 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 175.415 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.1 mt -101.39 149.84 36.69 Favored Pre-proline 0 C--N 1.315 -0.92 0 C-N-CA 124.993 1.317 . . . . 0.0 109.18 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 56.7 Cg_endo -66.13 -24.79 51.4 Favored 'Trans proline' 0 C--N 1.377 2.073 0 C-N-CA 122.07 1.846 . . . . 0.0 111.44 179.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.627 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . . . -60.64 -47.45 86.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.813 0.845 . . . . 0.0 110.267 170.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -71.17 -32.68 69.2 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.808 -175.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.512 HD21 ' HG3' ' A' ' 80' ' ' GLU . 72.9 mt -75.63 -23.04 56.3 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.551 0.74 . . . . 0.0 111.175 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.41 52.62 4.72 Favored Glycine 0 C--N 1.344 1.026 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 -175.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 71.5 mtp -97.58 174.87 6.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.678 0.791 . . . . 0.0 110.148 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.5 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 38.6 tt0 -133.99 155.8 49.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.241 0.616 . . . . 0.0 110.576 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 p -63.05 115.19 4.21 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 165.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.54 52.63 3.3 Favored Glycine 0 C--N 1.342 0.879 0 N-CA-C 111.613 -0.595 . . . . 0.0 111.613 -169.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t70 -110.07 -159.46 0.68 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.4 tp -142.93 143.54 32.04 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.865 0.841 . . . . 0.0 110.576 -175.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.2 mt -139.3 150.78 22.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 C-N-CA 126.472 1.909 . . . . 0.0 106.734 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -121.68 168.04 12.24 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 109.625 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.666 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 44.0 t -142.41 105.3 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 -174.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 94.6 m95 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 121.736 0.779 . . . . 0.0 109.636 -175.743 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 . . . . . 0 C--O 1.24 0.565 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 82' ' ' PRO . 77.2 mt -108.21 125.98 52.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.886 1.274 . . . . 0.0 109.53 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.53 102.92 14.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 42.4 mt -110.39 131.44 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.08 0.552 . . . . 0.0 109.75 -173.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 92' ' ' LEU . 64.4 mtt85 -94.3 109.94 21.72 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.518 0.727 . . . . 0.0 109.213 -178.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -101.13 127.63 54.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.451 ' HG2' HG23 ' A' ' 38' ' ' THR . 70.8 mt-30 -134.45 153.1 52.1 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -177.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.534 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 N--CA 1.463 0.435 0 O-C-N 123.399 0.437 . . . . 0.0 112.766 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.451 HG23 ' HG2' ' A' ' 31' ' ' GLN . 90.7 m . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 tp -142.59 144.66 32.96 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.585 1.154 . . . . 0.0 108.158 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -120.22 115.68 24.09 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.42 150.05 27.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 123.936 0.894 . . . . 0.0 110.134 -170.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.7 m -92.21 108.57 20.05 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.7 tp -105.54 123.59 48.15 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.2 m -72.87 147.71 45.11 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -177.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.34 -27.69 68.68 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.955 0.902 . . . . 0.0 112.482 -171.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -101.07 -12.05 19.15 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.549 0.739 . . . . 0.0 111.006 -178.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 67.7 m -83.82 134.8 43.66 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 123.293 0.637 . . . . 0.0 109.819 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.586 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 2.7 Cg_exo -67.78 158.01 59.19 Favored 'Trans proline' 0 C--N 1.368 1.554 0 C-N-CA 122.707 2.271 . . . . 0.0 113.122 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.65 HD11 ' HE1' ' A' ' 87' ' ' MET . 4.0 mm? -54.24 -30.78 51.43 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.782 1.233 . . . . 0.0 111.974 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.586 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.57 -34.37 69.13 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.487 HG22 ' O ' ' A' ' 48' ' ' PRO . 2.8 t -71.77 -33.01 68.27 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 120.862 0.363 . . . . 0.0 110.936 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 tt -68.43 -41.76 79.89 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.539 1.135 . . . . 0.0 110.356 173.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.464 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.5 -48.31 81.22 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.189 0.995 . . . . 0.0 109.74 176.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 t -63.1 -38.73 92.36 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 113.998 -1.455 . . . . 0.0 110.901 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -63.02 -50.1 72.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.004 0.522 . . . . 0.0 110.06 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.495 ' CE2' HG21 ' A' ' 95' ' ' VAL . 48.2 t80 -55.82 -57.03 13.74 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.558 1.143 . . . . 0.0 112.389 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -65.77 -42.5 90.77 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.374 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -63.8 -38.22 90.28 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 123.753 0.821 . . . . 0.0 113.098 -179.965 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.459 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.762 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.421 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 17.4 m -77.23 153.06 34.4 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.859 0.463 . . . . 0.0 111.089 -176.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -125.61 125.61 43.41 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.084 0.954 . . . . 0.0 109.317 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -124.86 143.67 50.71 Favored 'General case' 0 C--O 1.212 -0.881 0 C-N-CA 124.001 0.92 . . . . 0.0 109.973 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -118.91 105.48 11.53 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.6 t70 55.76 28.33 12.11 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 124.145 0.978 . . . . 0.0 111.691 -170.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.04 1.5 79.38 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.692 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.3 m -79.1 119.62 22.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.474 0.71 . . . . 0.0 109.413 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.65 114.01 8.31 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.6 mt -83.4 126.69 33.0 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -83.38 -34.44 25.57 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.507 0.723 . . . . 0.0 111.845 -175.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.99 -60.87 0.56 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.57 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 57.3 mtp85 -84.02 5.96 23.84 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -169.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.6 pm0 -76.31 147.86 37.9 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 170.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -100.1 162.7 20.15 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 124.424 1.09 . . . . 0.0 108.883 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.494 ' HB2' HD12 ' A' ' 26' ' ' LEU . 62.9 Cg_endo -66.8 -23.51 48.05 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 121.606 1.537 . . . . 0.0 111.01 174.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.97 -32.95 73.72 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.919 0.887 . . . . 0.0 111.244 171.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.61 -47.63 21.73 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.723 0.809 . . . . 0.0 110.922 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.492 HD21 ' HG3' ' A' ' 80' ' ' GLU . 77.3 mt -72.13 -15.29 61.98 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.32 0.648 . . . . 0.0 111.404 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.36 28.36 55.82 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.529 0.518 . . . . 0.0 112.534 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.65 ' HE1' HD11 ' A' ' 49' ' ' LEU . 66.2 mtm -84.36 168.21 15.8 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.72 0.808 . . . . 0.0 111.593 177.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -155.87 169.3 24.73 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.715 1.206 . . . . 0.0 108.367 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 m -57.39 112.25 1.35 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.26 0.624 . . . . 0.0 110.911 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 122.71 -14.21 8.6 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-O 119.624 -0.542 . . . . 0.0 113.629 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.49 170.46 1.02 Allowed 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 175.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 29' ' ' ARG . 43.9 tp -132.61 111.7 11.43 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.877 -169.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 56.8 mt -100.63 152.31 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.525 1.13 . . . . 0.0 108.182 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -115.45 163.33 15.88 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.687 1.195 . . . . 0.0 108.741 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.534 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 22.3 t -136.97 110.1 8.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 124.465 1.106 . . . . 0.0 108.994 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.8 m95 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.792 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 10.4 pt20 . . . . . 0 CA--C 1.538 0.518 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.424 HD12 ' HB2' ' A' ' 82' ' ' PRO . 53.5 mt -114.29 128.91 56.58 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.47 1.508 . . . . 0.0 109.448 177.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.23 105.17 17.28 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.05 135.66 52.41 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.822 0.849 . . . . 0.0 109.831 -169.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 81.6 mtt180 -95.38 111.99 23.78 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.823 0.849 . . . . 0.0 110.313 -177.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.17 129.97 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.987 0.915 . . . . 0.0 109.874 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -131.05 146.67 52.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.76 0.824 . . . . 0.0 108.923 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.63 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . . . . . . 0 N--CA 1.466 0.693 0 C-N-CA 121.603 -0.332 . . . . 0.0 113.138 176.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 120.768 0.318 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -137.12 151.15 48.52 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.869 1.268 . . . . 0.0 107.582 173.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.613 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.0 pt-20 -131.3 126.35 35.13 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -135.23 147.72 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.798 -172.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.8 m -92.77 110.81 22.26 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.57 0.748 . . . . 0.0 109.042 -178.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 32.7 tp -110.26 130.79 55.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.328 1.051 . . . . 0.0 109.594 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 20.8 t -75.41 145.76 41.32 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.63 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.63 -21.36 65.62 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -172.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -106.17 -7.86 17.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.905 0.882 . . . . 0.0 111.849 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.9 m -90.37 134.54 30.97 Favored Pre-proline 0 CA--C 1.543 0.689 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.532 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 8.1 Cg_exo -63.5 155.35 63.09 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.899 2.4 . . . . 0.0 113.403 -178.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.0 mm? -53.28 -30.36 38.2 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 124.561 1.145 . . . . 0.0 111.874 173.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.532 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.85 -37.05 73.17 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.077 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.507 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -68.52 -33.47 74.17 Favored 'General case' 0 CA--C 1.561 1.367 0 CA-C-O 121.053 0.454 . . . . 0.0 110.759 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 tt -70.61 -38.33 73.97 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.718 1.207 . . . . 0.0 110.177 173.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.477 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 62.2 mtt -60.5 -40.02 89.85 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.212 1.005 . . . . 0.0 111.155 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -65.49 -38.44 89.75 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.477 1.111 . . . . 0.0 110.182 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -67.33 -47.55 70.16 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.611 0.364 . . . . 0.0 110.409 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.5 -55.83 27.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.406 0.682 . . . . 0.0 111.677 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.52 -38.15 88.85 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 123.674 0.609 . . . . 0.0 112.149 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -66.81 -47.75 71.07 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.569 0.348 . . . . 0.0 111.612 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.052 0 C-N-CA 124.113 0.965 . . . . 0.0 112.185 -177.571 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.475 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.621 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.493 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 74.9 m -99.39 175.08 5.98 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.498 0.719 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -141.51 139.03 33.18 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.448 1.099 . . . . 0.0 109.553 -163.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -123.28 143.45 50.05 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.0 0.92 . . . . 0.0 110.664 174.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.528 ' HB3' HD21 ' A' ' 76' ' ' LEU . 66.4 t80 -129.6 106.12 8.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 171.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.12 26.94 16.8 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.445 1.098 . . . . 0.0 110.761 -170.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 90.55 -13.12 66.35 Favored Glycine 0 C--N 1.349 1.278 0 CA-C-N 115.635 -0.712 . . . . 0.0 113.595 -176.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.6 m -68.5 126.68 30.42 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.444 0.698 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.493 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 21.7 tptm -68.85 113.2 6.06 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 123.714 0.634 . . . . 0.0 109.896 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.528 HD21 ' HB3' ' A' ' 71' ' ' PHE . 23.5 mt -88.13 111.4 21.54 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 174.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.9 t -80.58 -18.44 48.28 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.987 0.915 . . . . 0.0 111.04 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.38 -39.5 2.49 Favored Glycine 0 C--N 1.347 1.159 0 C-N-CA 123.094 0.378 . . . . 0.0 113.295 177.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -81.88 1.57 34.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.261 0.624 . . . . 0.0 112.0 -173.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -80.41 148.68 30.46 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 39.5 mt -101.67 153.38 37.95 Favored Pre-proline 0 C--N 1.306 -1.288 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 174.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.63 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.0 Cg_endo -66.81 -22.19 49.75 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.783 1.656 . . . . 0.0 111.354 176.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.81 98.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.669 0.787 . . . . 0.0 110.979 168.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -71.86 -45.49 61.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.925 0.89 . . . . 0.0 110.999 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.8 mt -75.8 -11.23 59.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.691 0.796 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.82 60.87 Favored Glycine 0 C--N 1.35 1.351 0 CA-C-N 116.946 -0.115 . . . . 0.0 113.238 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' MET . . . . . 0.432 ' HE1' HD11 ' A' ' 49' ' ' LEU . 61.2 mtt -73.0 161.85 30.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.022 0.929 . . . . 0.0 111.365 177.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -149.31 160.5 43.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.122 1.369 . . . . 0.0 107.696 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.9 t -60.07 111.74 1.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 176.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.65 -28.43 3.98 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-O 119.498 -0.612 . . . . 0.0 112.819 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.92 170.95 0.07 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 tp -132.55 109.58 9.87 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.812 -167.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.8 mt -96.41 152.79 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.235 1.014 . . . . 0.0 108.663 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -124.3 163.02 22.55 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -173.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.63 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 75.7 t -142.13 112.86 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 123.832 0.853 . . . . 0.0 109.231 -175.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.9 p-90 . . . . . 0 CA--C 1.537 0.443 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 172.391 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.704 ' N ' ' HG ' ' A' ' 23' ' ' SER . 24.3 p . . . . . 0 CA--C 1.551 0.997 0 CA-C-O 119.871 -0.109 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -141.17 -45.0 0.38 Allowed 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.773 0.429 . . . . 0.0 110.352 175.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.8 p -108.12 79.76 1.3 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 168.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.704 ' HG ' ' N ' ' A' ' 20' ' ' THR . 6.4 m -100.76 115.22 29.79 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.574 -1.194 . . . . 0.0 110.742 -170.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -66.06 -52.37 49.56 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.217 0.607 . . . . 0.0 109.453 176.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -130.41 154.97 47.16 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.012 0.925 . . . . 0.0 108.69 172.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' ' 82' ' ' PRO . 71.4 mt -106.03 126.67 52.47 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.599 1.16 . . . . 0.0 109.072 -177.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -88.53 102.16 14.65 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 54.6 mt -109.04 129.4 55.46 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.851 0.861 . . . . 0.0 109.581 -171.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.657 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 58.9 mtt180 -87.64 105.86 17.63 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -99.76 114.22 37.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -137.05 145.51 44.11 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -169.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.592 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -86.55 174.53 46.72 Favored Glycine 0 C--N 1.339 0.73 0 O-C-N 123.423 0.452 . . . . 0.0 113.588 -173.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -44.64 -32.1 1.36 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.362 1.465 . . . . 0.0 112.697 166.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -91.15 135.82 33.51 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.222 1.009 . . . . 0.0 108.585 173.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -71.13 -20.28 62.34 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 117.925 0.329 . . . . 0.0 111.035 175.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -69.3 -34.55 74.87 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.641 0.777 . . . . 0.0 110.178 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -74.32 118.53 17.38 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 91.3 m -159.0 113.53 2.45 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -156.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.1 tp -143.24 153.58 42.96 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.002 0.365 . . . . 0.0 110.218 169.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.657 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 12.4 pt-20 -133.78 133.97 42.34 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 164.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.8 p -142.05 153.98 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 123.61 0.764 . . . . 0.0 109.785 -174.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.6 m -93.26 107.28 19.13 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.6 tp -95.13 128.86 42.3 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.1 t -72.48 141.44 48.57 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 -178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.475 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.42 -28.53 69.86 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.18 0.592 . . . . 0.0 112.156 -171.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -91.09 -18.09 25.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.909 0.884 . . . . 0.0 111.524 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 m -94.05 129.11 38.58 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 123.525 0.73 . . . . 0.0 109.44 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.482 ' O ' HG22 ' A' ' 51' ' ' THR . 8.4 Cg_endo -67.12 161.98 40.37 Favored 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.583 2.188 . . . . 0.0 114.174 -175.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.45 -30.32 40.1 Favored 'General case' 0 C--O 1.216 -0.667 0 C-N-CA 125.496 1.519 . . . . 0.0 112.207 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -38.39 72.84 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.482 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -69.37 -28.68 66.41 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 120.856 0.36 . . . . 0.0 110.883 179.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -74.37 -39.08 62.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.143 0.977 . . . . 0.0 110.268 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -60.54 -42.37 96.4 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.992 0.917 . . . . 0.0 111.213 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.2 p -71.27 -37.27 71.9 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -65.23 -48.81 71.99 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.132 0.573 . . . . 0.0 110.429 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -53.15 -57.46 10.39 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.58 1.552 . . . . 0.0 112.235 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -60.04 -41.19 91.73 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.779 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.83 -40.58 95.78 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.83 80.29 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.632 0.773 . . . . 0.0 112.589 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 69.8 mtm -107.71 27.29 9.33 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.235 0.614 . . . . 0.0 111.949 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 49.05 36.11 20.23 Favored Glycine 0 CA--C 1.541 1.66 0 N-CA-C 117.648 1.819 . . . . 0.0 117.648 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -90.97 18.62 6.44 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 124.072 0.949 . . . . 0.0 110.553 168.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.0 m -56.19 99.28 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.861 0.864 . . . . 0.0 111.256 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 120.73 -48.37 0.95 Allowed Glycine 0 C--N 1.345 1.057 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -84.66 77.55 10.03 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -80.14 139.47 36.81 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.573 -170.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -111.23 159.37 17.97 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.783 1.233 . . . . 0.0 109.618 -175.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -78.59 155.37 29.66 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.431 0.692 . . . . 0.0 111.691 -177.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -131.58 130.89 42.81 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.165 0.986 . . . . 0.0 109.582 -178.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -128.53 146.66 50.77 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.288 1.035 . . . . 0.0 110.756 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.572 ' HB3' HD21 ' A' ' 76' ' ' LEU . 11.7 t80 -142.93 119.69 11.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.638 1.175 . . . . 0.0 108.565 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.0 t70 57.2 32.64 22.06 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.325 1.05 . . . . 0.0 111.042 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.13 -17.38 28.18 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.441 -0.799 . . . . 0.0 113.655 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 63.4 m -73.37 123.8 24.51 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 123.902 0.881 . . . . 0.0 110.572 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -70.32 114.24 8.26 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 174.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.572 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.7 mt -81.1 112.88 18.87 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 176.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.5 t -76.36 -21.77 55.68 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.55 0.74 . . . . 0.0 110.969 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.05 -31.84 6.07 Favored Glycine 0 C--N 1.345 1.042 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.49 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -91.75 9.73 31.35 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.09 0.956 . . . . 0.0 111.959 -172.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.433 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.0 pm0 -93.92 148.64 21.95 Favored 'General case' 0 C--O 1.23 0.07 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 166.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 mt -94.69 155.83 38.98 Favored Pre-proline 0 C--N 1.314 -0.972 0 C-N-CA 125.213 1.405 . . . . 0.0 108.36 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.56 ' HB2' HD12 ' A' ' 26' ' ' LEU . 63.1 Cg_endo -67.18 -36.14 22.48 Favored 'Trans proline' 0 C--N 1.368 1.603 0 C-N-CA 121.575 1.516 . . . . 0.0 111.089 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.61 -27.51 66.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.477 0.711 . . . . 0.0 111.184 174.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -70.05 -43.43 71.25 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.635 0.774 . . . . 0.0 110.844 175.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.433 HD21 ' HG3' ' A' ' 80' ' ' GLU . 83.9 mt -71.88 -21.46 61.65 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.732 0.813 . . . . 0.0 111.211 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.21 42.6 7.43 Favored Glycine 0 C--N 1.347 1.194 0 N-CA-C 111.768 -0.533 . . . . 0.0 111.768 -178.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.407 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 73.9 mtp -95.55 165.11 12.5 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.92 0.888 . . . . 0.0 110.539 -178.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.7 tp10 -147.8 162.46 39.17 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.409 0.684 . . . . 0.0 109.734 -177.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.651 ' HG ' ' N ' ' A' ' 20' ' ' THR . 33.7 p -59.64 119.87 8.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.718 0.807 . . . . 0.0 110.996 176.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 98.19 36.07 4.8 Favored Glycine 0 C--N 1.341 0.861 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.43 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t0 -98.38 -172.08 2.26 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 -178.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.8 tp -142.43 109.91 5.71 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -177.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 32.7 mt -94.41 148.5 4.91 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 167.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -119.72 156.82 29.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 -176.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.592 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 39.5 t -137.76 136.93 45.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -175.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 80.5 m95 -135.19 135.42 41.01 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.998 0.919 . . . . 0.0 108.829 -175.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.206 0 CA-C-O 118.716 -1.047 . . . . 0.0 112.02 -177.753 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.7 m . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -140.62 -45.99 0.41 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.716 0.406 . . . . 0.0 111.5 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 59.2 p -110.95 78.94 1.15 Allowed 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -171.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -103.51 67.35 0.91 Allowed 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 155.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -83.12 -60.21 2.22 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 173.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -129.76 154.55 47.1 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.47 178.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.401 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 7.8 mp -98.79 109.15 21.95 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 113.645 -1.616 . . . . 0.0 108.131 -176.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -81.49 102.91 10.86 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.487 HD22 ' HB2' ' A' ' 91' ' ' ASP . 39.8 mt -108.7 135.84 49.27 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -174.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -91.84 130.02 37.69 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -121.89 117.84 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.487 HE21 HD11 ' A' ' 92' ' ' LEU . 39.6 mt-30 -132.1 139.44 48.48 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 -172.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.463 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -91.29 -176.35 43.41 Favored Glycine 0 C--N 1.34 0.779 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -70.65 20.49 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 173.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -158.08 145.88 18.46 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.242 1.017 . . . . 0.0 108.963 178.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -65.78 -21.16 66.48 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.507 0.723 . . . . 0.0 111.672 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -56.27 -38.19 70.84 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.143 0.977 . . . . 0.0 110.299 172.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.515 ' HG3' ' HG2' ' A' ' 60' ' ' MET . 2.4 mp0 -97.94 81.98 2.93 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.442 172.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.4 m -125.47 120.15 30.17 Favored 'General case' 0 N--CA 1.482 1.158 0 O-C-N 121.809 -0.557 . . . . 0.0 110.404 163.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.2 tp -131.88 154.32 49.32 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.008 0.923 . . . . 0.0 108.634 176.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -132.49 134.11 44.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 162.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.68 149.76 33.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 124.194 0.998 . . . . 0.0 109.637 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.5 m -91.78 108.34 19.85 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.1 tp -96.32 131.13 43.16 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.04 0.936 . . . . 0.0 109.611 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.3 m -78.81 138.11 38.03 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.579 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.7 ptm180 -63.21 -23.83 67.6 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -175.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -86.08 -18.71 31.65 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.87 0.468 . . . . 0.0 110.533 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -92.28 134.19 28.74 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.168 0.987 . . . . 0.0 109.764 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.463 ' O ' HG22 ' A' ' 51' ' ' THR . 1.2 Cg_endo -70.43 164.92 33.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.558 2.172 . . . . 0.0 113.06 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -58.58 -24.63 61.26 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 111.921 178.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -34.61 71.56 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.453 0.701 . . . . 0.0 111.981 -179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.463 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.4 t -74.47 -31.85 62.38 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-O 120.812 0.339 . . . . 0.0 110.548 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.6 tt -67.26 -42.11 84.45 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.547 1.139 . . . . 0.0 110.181 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 61.8 mtt -57.65 -47.24 82.8 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.12 0.968 . . . . 0.0 110.476 172.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 m -65.01 -30.47 71.46 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.679 1.237 . . . . 0.0 110.062 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 26.4 t60 -70.66 -56.6 6.08 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.79 -60.99 2.67 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.684 1.194 . . . . 0.0 112.521 -174.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 53' ' ' MET . 11.3 pt-20 -60.71 -36.81 79.74 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -176.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -74.35 -34.76 63.48 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.69 -49.34 14.69 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.528 0.731 . . . . 0.0 111.011 -176.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.515 ' HG2' ' HG3' ' A' ' 37' ' ' GLN . 51.4 tpp -73.66 -14.5 61.17 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.045 -173.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.87 16.67 25.37 Favored Glycine 0 C--N 1.353 1.519 0 O-C-N 122.448 -0.158 . . . . 0.0 113.419 174.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -91.12 33.52 0.96 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.161 0.984 . . . . 0.0 110.299 175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.5 m -74.06 103.22 4.45 Favored 'General case' 0 C--O 1.243 0.721 0 C-N-CA 123.639 0.776 . . . . 0.0 110.28 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 113.75 -3.73 24.49 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.539 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -139.53 105.05 5.09 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.914 0.886 . . . . 0.0 109.379 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -85.41 148.94 25.76 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.427 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.62 163.76 24.35 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.157 0.983 . . . . 0.0 109.817 -177.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.3 m -82.1 148.58 28.47 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.409 0.683 . . . . 0.0 109.665 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.463 ' HB3' HD23 ' A' ' 76' ' ' LEU . 45.1 m-85 -122.82 128.85 50.96 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -129.83 127.54 40.48 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.142 0.496 . . . . 0.0 111.714 178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -122.45 106.95 11.5 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.036 1.334 . . . . 0.0 107.86 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.2 t70 49.32 47.92 21.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.583 1.153 . . . . 0.0 111.485 -174.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 82.37 -22.34 6.37 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 114.778 -1.101 . . . . 0.0 114.212 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.9 m -71.21 111.92 6.93 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.324 0.65 . . . . 0.0 110.097 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -68.87 114.13 6.92 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.463 HD23 ' HB3' ' A' ' 69' ' ' PHE . 1.1 mm? -75.27 108.22 7.89 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 176.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.5 m -72.52 -29.18 63.37 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.13 0.972 . . . . 0.0 111.839 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.91 -58.13 0.58 Allowed Glycine 0 C--N 1.345 1.068 0 CA-C-N 116.687 -0.233 . . . . 0.0 113.116 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -88.74 10.58 20.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.737 0.815 . . . . 0.0 112.894 -166.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.572 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -86.35 149.1 25.27 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 170.403 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 42.5 mt -98.43 151.47 37.49 Favored Pre-proline 0 C--N 1.314 -0.976 0 C-N-CA 125.13 1.372 . . . . 0.0 108.975 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.579 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 40.0 Cg_endo -64.71 -36.1 43.0 Favored 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 121.829 1.686 . . . . 0.0 111.498 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.19 81.93 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.427 0.691 . . . . 0.0 111.151 173.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.49 -34.24 76.73 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.877 0.871 . . . . 0.0 111.322 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.572 HD21 ' HG3' ' A' ' 80' ' ' GLU . 56.6 mt -80.77 -23.4 39.36 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.726 0.811 . . . . 0.0 111.79 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.45 22.85 25.63 Favored Glycine 0 CA--C 1.531 1.053 0 CA-C-N 116.005 -0.543 . . . . 0.0 112.7 -175.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.447 ' HE3' HD13 ' A' ' 85' ' ' LEU . 52.7 mtt -74.28 168.95 18.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.169 0.988 . . . . 0.0 111.093 173.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.4 ' HG2' ' H ' ' A' ' 89' ' ' SER . 34.6 tt0 -154.57 174.04 15.49 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -179.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' A' ' 26' ' ' LEU . 28.5 p -62.61 13.97 0.02 OUTLIER 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -174.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -158.66 63.68 0.3 Allowed Glycine 0 C--N 1.347 1.145 0 CA-C-N 118.61 0.641 . . . . 0.0 111.614 171.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.487 ' HB2' HD22 ' A' ' 28' ' ' LEU . 0.7 OUTLIER -110.58 -171.73 1.89 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.601 0.76 . . . . 0.0 110.318 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.487 HD11 HE21 ' A' ' 31' ' ' GLN . 49.0 tp -139.46 144.63 38.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.414 0.686 . . . . 0.0 109.435 -173.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 62.1 mt -134.09 136.23 53.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -125.12 100.97 6.8 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -170.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.463 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 34.0 t -71.66 128.54 34.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.788 174.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -101.1 94.0 5.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 169.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.261 1.79 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.062 -177.357 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.59 HG21 HE21 ' A' ' 24' ' ' GLN . 55.8 m . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -100.09 -27.25 13.64 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.462 0.705 . . . . 0.0 111.231 177.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.1 p -70.61 121.08 17.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.58 0.752 . . . . 0.0 109.325 176.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 m -39.78 100.57 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 125.54 1.536 . . . . 0.0 113.424 -170.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.59 HE21 HG21 ' A' ' 20' ' ' THR . 8.5 tp-100 -81.14 -38.29 27.41 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.164 -1.38 . . . . 0.0 111.469 -170.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.602 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.2 OUTLIER -89.34 142.87 27.27 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.578 -1.192 . . . . 0.0 112.641 -165.749 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 mt -109.57 145.6 36.09 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 125.959 1.704 . . . . 0.0 108.742 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -83.01 98.42 9.25 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 175.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.433 HD13 HD11 ' A' ' 93' ' ' ILE . 77.0 mt -107.75 121.89 45.63 Favored 'General case' 0 C--O 1.242 0.663 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 178.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.449 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 82.6 mtt85 -88.87 133.75 34.18 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -125.75 129.69 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -133.38 144.36 49.53 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.036 0.534 . . . . 0.0 110.08 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.612 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -81.37 171.69 53.31 Favored Glycine 0 C--N 1.345 1.052 0 O-C-N 123.654 0.596 . . . . 0.0 112.685 175.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -41.18 -34.05 0.42 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.589 1.156 . . . . 0.0 112.398 163.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.405 ' H ' ' HG2' ' A' ' 34' ' ' GLU . 6.5 pt-20 -93.21 105.64 17.7 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -71.25 -14.42 62.23 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -168.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -65.14 -31.04 72.03 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.207 0.603 . . . . 0.0 110.086 172.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.72 87.84 1.72 Allowed 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.3 m -121.66 127.66 51.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.655 0.782 . . . . 0.0 110.042 -176.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -140.0 131.26 26.62 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.543 1.137 . . . . 0.0 108.042 -178.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.449 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.8 pt-20 -119.01 125.15 48.7 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.0 p -128.63 153.87 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.56 -171.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.8 m -91.42 108.68 20.06 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.451 HD21 HD22 ' A' ' 49' ' ' LEU . 23.1 tp -107.1 124.75 50.13 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 122.872 0.469 . . . . 0.0 109.746 175.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.602 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 43.1 m -72.52 134.99 45.54 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.641 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.0 ptm180 -73.55 -11.32 60.4 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -171.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -92.45 -17.58 24.37 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.865 0.866 . . . . 0.0 110.325 171.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -94.18 143.88 27.12 Favored Pre-proline 0 C--N 1.354 0.761 0 C-N-CA 124.013 0.925 . . . . 0.0 109.701 -178.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.478 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -72.81 160.57 45.86 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.706 2.271 . . . . 0.0 112.928 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.514 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.1 mm? -56.64 -23.94 44.84 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.399 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -37.55 73.77 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -71.0 -27.88 64.02 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-O 121.008 0.433 . . . . 0.0 110.911 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -74.0 -41.18 62.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.945 0.898 . . . . 0.0 110.286 172.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -55.35 -44.28 75.81 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.057 0.943 . . . . 0.0 110.781 176.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -72.26 -35.97 68.92 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.443 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -70.22 -48.11 58.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.263 0.625 . . . . 0.0 110.537 -175.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -55.3 -58.85 6.03 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.349 1.06 . . . . 0.0 111.621 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.541 ' HA ' HD23 ' A' ' 62' ' ' LEU . 13.8 pt-20 -58.59 -28.71 65.84 Favored 'General case' 0 N--CA 1.481 1.101 0 O-C-N 123.913 0.758 . . . . 0.0 112.409 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.56 -40.65 63.78 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.22 -52.23 66.44 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -172.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -101.47 36.75 1.95 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 122.102 -0.374 . . . . 0.0 110.46 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 38.43 52.8 2.31 Favored Glycine 0 CA--C 1.541 1.658 0 N-CA-C 116.235 1.254 . . . . 0.0 116.235 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.541 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.0 mm? -77.59 9.23 3.51 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.378 0.671 . . . . 0.0 111.583 175.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.6 p -61.59 95.55 0.05 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.327 1.051 . . . . 0.0 110.062 173.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 163.1 -48.0 0.32 Allowed Glycine 0 C--N 1.338 0.647 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 -175.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.3 mtm105 -131.58 128.12 38.55 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.08 138.85 31.14 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 172.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.44 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -117.89 154.24 32.19 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.224 1.01 . . . . 0.0 110.374 -173.149 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.44 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 16.4 m -84.47 161.12 20.4 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.514 0.726 . . . . 0.0 110.623 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.428 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 32.0 m-85 -128.13 127.54 43.21 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.012 0.925 . . . . 0.0 109.156 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -123.08 137.13 55.01 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.77 0.828 . . . . 0.0 110.764 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.535 ' HB3' HD21 ' A' ' 76' ' ' LEU . 28.2 t80 -116.79 110.52 18.51 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.731 1.212 . . . . 0.0 108.318 174.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.1 t70 52.5 39.06 27.16 Favored 'General case' 0 CA--C 1.562 1.442 0 CA-C-O 121.815 0.817 . . . . 0.0 111.019 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 71.52 22.52 78.62 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 114.91 -1.041 . . . . 0.0 114.656 -177.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.3 m -102.98 120.44 40.64 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.085 0.954 . . . . 0.0 109.128 177.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.0 114.99 6.22 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.91 0.484 . . . . 0.0 110.229 177.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.535 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.2 mt -84.6 120.89 26.88 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 27.4 m -77.13 -35.47 56.19 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.777 0.831 . . . . 0.0 112.509 -175.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.73 7.02 13.85 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 123.291 0.472 . . . . 0.0 113.49 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -127.59 10.89 6.71 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 124.036 0.934 . . . . 0.0 110.763 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.435 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.2 pm0 -105.08 147.84 27.45 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 174.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.99 154.17 37.45 Favored Pre-proline 0 C--N 1.311 -1.068 0 C-N-CA 125.276 1.43 . . . . 0.0 108.579 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.641 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 44.7 Cg_endo -65.43 -29.35 53.69 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.749 1.632 . . . . 0.0 111.187 177.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.17 93.68 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.202 0.601 . . . . 0.0 110.596 172.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.03 -38.23 82.28 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.895 0.878 . . . . 0.0 111.909 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.435 HD21 ' HG3' ' A' ' 80' ' ' GLU . 70.2 mt -77.14 -24.77 51.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.649 0.779 . . . . 0.0 111.437 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.34 24.86 20.6 Favored Glycine 0 C--N 1.348 1.202 0 C-N-CA 122.036 -0.126 . . . . 0.0 113.035 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.514 ' HE1' HD11 ' A' ' 49' ' ' LEU . 63.1 mtt -74.76 170.63 15.48 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.304 1.041 . . . . 0.0 110.798 171.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -155.61 174.7 14.91 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 15.04 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -172.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -154.66 55.59 0.42 Allowed Glycine 0 C--N 1.342 0.903 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 168.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -106.97 -173.2 2.24 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.7 tp -140.02 134.74 31.84 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 121.72 0.771 . . . . 0.0 110.064 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.433 HD11 HD13 ' A' ' 28' ' ' LEU . 48.9 mt -127.94 151.95 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.558 1.543 . . . . 0.0 108.549 -178.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -116.78 165.04 13.76 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 124.504 1.121 . . . . 0.0 108.538 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.612 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 15.8 t -140.9 112.56 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.314 1.046 . . . . 0.0 108.805 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -115.28 98.01 6.52 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.495 1.118 . . . . 0.0 108.947 -176.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.41 ' HA3' ' HB3' ' A' ' 67' ' ' LEU . . . . . . . . 0 C--O 1.25 1.144 0 CA-C-O 118.917 -0.935 . . . . 0.0 111.136 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.516 ' HG3' HG22 ' A' ' 22' ' ' THR . 10.2 pt-20 -67.73 -34.96 77.87 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.244 0.618 . . . . 0.0 109.663 172.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.516 HG22 ' HG3' ' A' ' 21' ' ' GLU . 7.5 t -153.33 157.9 40.74 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.901 1.281 . . . . 0.0 108.116 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.4 t -66.2 -33.38 75.62 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.108 0.563 . . . . 0.0 111.857 -174.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -66.34 -14.74 62.52 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -171.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -113.72 152.5 30.43 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.57 0.7 . . . . 0.0 111.464 -179.182 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt -113.29 150.16 32.89 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.787 1.635 . . . . 0.0 108.722 177.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.17 108.09 19.42 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.547 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.4 mm? -109.47 141.86 41.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -176.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -97.72 123.77 41.78 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.792 0.837 . . . . 0.0 109.42 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -110.17 116.6 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -177.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -132.06 139.06 48.41 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.744 0.418 . . . . 0.0 110.069 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.559 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -100.64 179.31 29.1 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 123.512 0.508 . . . . 0.0 113.892 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -50.73 -15.27 0.26 Allowed 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 171.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -97.63 144.88 26.85 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.478 0.711 . . . . 0.0 109.151 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -67.51 -30.25 69.87 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 165.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -58.6 -38.1 77.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.599 1.56 . . . . 0.0 111.623 174.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -89.0 87.05 7.07 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.242 -169.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -124.66 131.86 53.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.296 0.638 . . . . 0.0 109.803 167.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -140.33 126.14 19.38 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.84 127.09 51.59 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.543 0.687 . . . . 0.0 109.184 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -133.88 151.11 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.061 0.944 . . . . 0.0 111.474 -168.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 67.8 m -93.39 106.92 18.83 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.015 176.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 28' ' ' LEU . 28.9 tp -107.34 131.94 53.68 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.427 1.091 . . . . 0.0 109.309 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.518 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 35.1 m -77.8 144.64 36.94 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.655 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 11.9 ptm85 -71.05 -9.32 57.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.575 0.35 . . . . 0.0 111.934 -175.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -94.86 -30.84 13.99 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.415 1.086 . . . . 0.0 109.849 176.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.3 m -82.11 139.28 45.72 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.969 0.907 . . . . 0.0 109.962 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.547 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 16.4 Cg_exo -62.21 153.79 67.41 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 122.962 2.441 . . . . 0.0 113.6 177.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.7 mm? -53.59 -29.5 37.86 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.596 170.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.547 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -58.22 -36.96 73.93 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.08 0.552 . . . . 0.0 112.428 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.84 -33.23 75.36 Favored 'General case' 0 CA--C 1.561 1.38 0 CA-C-O 120.976 0.417 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -73.29 -42.61 62.21 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.929 1.292 . . . . 0.0 110.792 173.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.436 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 65.9 mtt -57.06 -46.04 82.76 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.444 1.098 . . . . 0.0 110.503 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.1 p -69.67 -33.78 73.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.272 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -64.46 -52.19 59.26 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.625 0.77 . . . . 0.0 110.538 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.431 ' CZ ' HG21 ' A' ' 95' ' ' VAL . 52.5 t80 -52.92 -60.2 3.57 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 111.831 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.519 ' HA ' HD23 ' A' ' 62' ' ' LEU . 7.9 pt-20 -57.87 -34.19 69.5 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 124.283 0.99 . . . . 0.0 111.986 -177.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.81 -47.4 85.29 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 173.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.05 -43.47 73.84 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -112.72 30.14 7.38 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 122.487 0.315 . . . . 0.0 110.998 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 39.49 47.99 2.95 Favored Glycine 0 N--CA 1.481 1.693 0 N-CA-C 117.275 1.67 . . . . 0.0 117.275 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.0 mm? -73.17 82.88 1.32 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.713 . . . . 0.0 110.098 175.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.5 p -102.22 -58.28 1.91 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.967 0.907 . . . . 0.0 110.249 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.75 -36.5 61.73 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.887 -179.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -106.91 97.65 7.41 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.2 tppt? -94.22 145.5 24.67 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.459 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -127.06 165.71 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.728 0.811 . . . . 0.0 111.434 -164.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.9 m -99.64 152.99 19.44 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.702 0.801 . . . . 0.0 110.169 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -115.59 127.25 55.09 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.751 0.82 . . . . 0.0 109.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -122.79 140.96 52.35 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.931 0.892 . . . . 0.0 110.005 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.508 ' HB3' HD21 ' A' ' 76' ' ' LEU . 67.2 t80 -129.74 114.17 15.64 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.941 0.896 . . . . 0.0 108.661 174.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 56.61 34.29 24.2 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.382 1.073 . . . . 0.0 110.459 -173.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 79.09 -2.65 68.97 Favored Glycine 0 C--N 1.353 1.492 0 CA-C-N 115.397 -0.819 . . . . 0.0 114.243 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 97.1 m -81.49 126.87 32.19 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 117.663 0.731 . . . . 0.0 110.233 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -71.27 116.02 11.11 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 123.735 0.647 . . . . 0.0 109.65 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.508 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.6 mt -87.51 130.32 34.76 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -92.45 -25.0 18.65 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.659 0.784 . . . . 0.0 111.489 -177.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 122.93 -41.56 1.77 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 123.167 0.413 . . . . 0.0 113.092 -178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -76.71 -18.75 58.32 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.985 0.914 . . . . 0.0 112.591 -170.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.53 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.8 pm0 -71.99 149.1 45.29 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 178.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.6 mt -103.95 152.02 38.99 Favored Pre-proline 0 C--N 1.312 -1.038 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.655 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 43.3 Cg_endo -64.03 -21.94 68.12 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.06 1.84 . . . . 0.0 111.708 -178.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.56 -44.35 89.66 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.054 0.941 . . . . 0.0 111.588 171.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -74.72 -39.71 61.74 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.614 0.766 . . . . 0.0 111.535 -176.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.53 HD21 ' HG3' ' A' ' 80' ' ' GLU . 95.0 mt -69.81 -23.27 63.3 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.07 0.548 . . . . 0.0 111.476 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.91 55.8 3.24 Favored Glycine 0 C--N 1.344 0.977 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 -174.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.444 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 61.0 mtp -107.74 159.62 16.34 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.075 0.95 . . . . 0.0 109.33 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -148.59 165.94 29.76 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 22.7 t -59.92 108.65 0.79 Allowed 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 131.52 -31.95 3.02 Favored Glycine 0 C--N 1.354 1.534 0 CA-C-O 119.363 -0.687 . . . . 0.0 113.669 -174.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.409 ' HB2' HD12 ' A' ' 28' ' ' LEU . 1.2 m-20 -54.15 167.24 0.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -177.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.7 tp -131.61 110.48 10.97 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 121.468 0.652 . . . . 0.0 109.538 -162.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.42 HD11 ' HE1' ' A' ' 87' ' ' MET . 38.3 mt -90.65 148.75 4.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.354 173.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -114.92 156.91 24.13 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 -171.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.559 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 19.0 t -135.04 109.23 11.09 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -102.86 94.03 5.37 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.398 -1.273 . . . . 0.0 108.043 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.896 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 -178.824 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -141.09 -17.62 0.82 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -166.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.7 p -61.38 119.89 9.39 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 121.165 1.802 . . . . 0.0 111.346 -135.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 t -100.29 130.78 46.44 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 110.896 -2.866 . . . . 0.0 115.611 -134.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -80.41 -54.88 5.3 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 155.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -130.69 152.67 49.8 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.225 1.01 . . . . 0.0 109.963 175.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.3 mt -97.1 123.54 40.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.449 1.5 . . . . 0.0 107.734 174.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -85.73 103.26 14.36 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -178.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 44.2 mt -111.25 132.87 54.01 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -175.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 mtt85 -99.48 126.86 45.49 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -178.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.95 133.03 52.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.704 -175.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -139.9 153.43 46.97 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.884 0.873 . . . . 0.0 108.936 174.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.546 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -91.75 -170.62 41.87 Favored Glycine 0 C--N 1.34 0.764 0 O-C-N 123.526 0.516 . . . . 0.0 112.635 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -37.5 -39.94 0.35 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.084 0.954 . . . . 0.0 111.801 157.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -89.92 112.67 24.13 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 168.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.58 -17.56 62.29 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 120.73 0.3 . . . . 0.0 110.825 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -71.65 -27.88 63.38 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.401 0.68 . . . . 0.0 110.09 171.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -76.04 87.57 2.96 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.5 m -115.13 136.99 52.52 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.515 0.726 . . . . 0.0 110.894 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 tp -137.71 134.88 35.89 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 166.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -109.77 125.36 52.62 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 p -134.26 146.68 30.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.794 0.838 . . . . 0.0 110.605 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.7 p -95.55 107.68 19.87 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 175.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HB2' HD12 ' A' ' 52' ' ' LEU . 26.5 tp -88.49 131.14 35.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.547 -0.752 . . . . 0.0 108.992 175.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.5 m -73.82 139.88 45.41 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -61.91 -27.94 69.18 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.471 0.708 . . . . 0.0 112.477 -171.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -86.85 -27.76 23.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.101 0.96 . . . . 0.0 111.277 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -84.9 133.78 42.75 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.484 0.714 . . . . 0.0 110.842 -168.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.546 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 6.1 Cg_exo -60.09 157.05 36.22 Favored 'Trans proline' 0 C--N 1.378 2.113 0 C-N-CA 122.74 2.293 . . . . 0.0 113.085 177.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.489 HD11 ' HE1' ' A' ' 87' ' ' MET . 4.0 mm? -55.02 -26.98 40.88 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.581 1.152 . . . . 0.0 112.236 176.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.546 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.0 pttt -59.49 -33.3 71.16 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 48' ' ' PRO . 3.0 t -68.76 -32.48 72.25 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.343 0.592 . . . . 0.0 110.21 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' ' 43' ' ' LEU . 7.0 tt -74.15 -38.69 63.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.925 1.29 . . . . 0.0 110.376 173.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.9 mtt -59.04 -41.29 87.48 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.014 0.926 . . . . 0.0 110.592 176.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.427 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 24.1 m -64.44 -41.85 96.33 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 124.634 1.209 . . . . 0.0 109.789 176.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.42 -50.1 74.2 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.074 0.55 . . . . 0.0 110.495 -176.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -55.42 -58.01 9.52 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.958 0.903 . . . . 0.0 112.178 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.98 -39.1 93.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.23 -0.896 . . . . 0.0 111.982 -174.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 54' ' ' SER . 30.6 mm-40 -65.76 -46.33 79.19 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 176.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.26 -53.25 60.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.302 1.041 . . . . 0.0 113.566 -171.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 63.2 mtm -104.06 36.73 2.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.731 0.412 . . . . 0.0 111.546 -174.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 43.85 53.59 6.26 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 116.843 1.497 . . . . 0.0 116.843 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -87.04 45.99 1.33 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.631 0.772 . . . . 0.0 109.141 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.5 m -74.01 124.35 26.07 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.811 0.844 . . . . 0.0 110.807 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.84 -58.14 3.3 Favored Glycine 0 C--N 1.344 1.008 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -178.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 45.8 mtm105 -75.29 101.61 4.76 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.342 0.657 . . . . 0.0 110.426 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 tppt? -79.63 148.27 31.72 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 172.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.49 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.93 155.33 45.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.161 0.984 . . . . 0.0 109.599 -177.076 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 17.5 m -85.68 150.69 24.43 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.484 0.714 . . . . 0.0 110.347 -176.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -119.89 130.11 54.69 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.711 0.804 . . . . 0.0 109.88 176.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.451 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 17.6 m-85 -124.63 155.59 38.9 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.009 0.924 . . . . 0.0 110.335 175.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.516 ' HB3' HD21 ' A' ' 76' ' ' LEU . 56.9 t80 -140.25 112.32 7.65 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.37 1.068 . . . . 0.0 108.956 172.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 57.3 32.12 21.23 Favored 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 124.355 1.062 . . . . 0.0 110.995 -174.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.22 -0.45 89.71 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.645 -1.161 . . . . 0.0 114.28 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 86.3 m -83.54 122.12 28.14 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.346 0.658 . . . . 0.0 110.084 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -67.42 114.32 6.01 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.516 HD21 ' HB3' ' A' ' 71' ' ' PHE . 30.6 mt -86.42 118.93 26.17 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -78.77 -30.56 45.69 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.72 0.808 . . . . 0.0 112.473 -176.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 130.6 -47.28 1.03 Allowed Glycine 0 CA--C 1.524 0.604 0 CA-C-N 116.302 -0.408 . . . . 0.0 112.827 -175.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -77.09 -19.74 56.64 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.439 0.696 . . . . 0.0 112.532 -169.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.469 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -69.58 149.03 48.61 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.792 0.806 . . . . 0.0 109.459 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 65.3 mt -101.96 157.4 33.77 Favored Pre-proline 0 C--N 1.309 -1.194 0 C-N-CA 125.17 1.388 . . . . 0.0 108.626 -174.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -65.24 -35.02 42.96 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 121.827 1.685 . . . . 0.0 111.515 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.31 -36.39 79.99 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.716 0.806 . . . . 0.0 111.163 173.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.66 -46.55 75.35 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.995 0.918 . . . . 0.0 111.473 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.469 HD21 ' HG3' ' A' ' 80' ' ' GLU . 55.6 mt -75.34 -17.1 60.33 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.254 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 84.22 22.73 53.87 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 116.132 -0.486 . . . . 0.0 113.111 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.489 ' HE1' HD11 ' A' ' 49' ' ' LEU . 48.5 mtt -64.51 152.16 42.52 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.339 1.056 . . . . 0.0 112.165 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -146.91 157.23 43.58 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 -175.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 54.7 p -56.6 117.42 3.86 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.194 0.598 . . . . 0.0 111.173 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 111.09 -8.65 29.2 Favored Glycine 0 C--N 1.34 0.758 0 CA-C-O 119.603 -0.554 . . . . 0.0 113.501 178.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -60.06 160.33 8.21 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 117.446 0.623 . . . . 0.0 111.868 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.2 tp -124.77 108.79 12.34 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 -163.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 55.6 mt -88.63 150.03 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 39.8 mt-10 -112.26 155.32 24.24 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.502 1.121 . . . . 0.0 108.216 -171.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.546 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 41.7 t -136.02 107.45 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 123.763 0.825 . . . . 0.0 108.836 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 9.7 m0 -101.85 97.58 7.94 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -177.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.186 -1.341 . . . . 0.0 111.141 -176.723 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -159.73 162.57 34.98 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 -171.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -74.83 150.51 39.25 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 169.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.3 m 60.54 29.73 19.23 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 124.395 1.078 . . . . 0.0 112.197 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -82.26 -14.12 55.97 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.57 0.748 . . . . 0.0 111.362 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.461 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 8.6 mp0 -81.56 131.37 35.27 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.107 -167.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 69.9 mt -97.0 125.85 41.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 124.28 1.032 . . . . 0.0 108.256 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -77.26 99.0 5.33 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 57.6 mt -112.39 133.72 54.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.481 0.712 . . . . 0.0 109.598 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -96.5 136.39 37.07 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.437 HG13 ' HB ' ' A' ' 93' ' ' ILE . 1.9 t -125.01 134.05 67.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -132.6 146.96 52.3 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-N 118.221 0.464 . . . . 0.0 110.496 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.593 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -97.06 174.13 29.75 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 124.023 0.827 . . . . 0.0 112.26 171.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -50.69 -19.45 0.94 Allowed 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 173.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -94.09 155.25 17.19 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.455 0.702 . . . . 0.0 110.179 -176.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.93 -47.08 72.8 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.685 0.794 . . . . 0.0 112.847 -171.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -87.94 -17.31 31.59 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.374 0.67 . . . . 0.0 110.935 -176.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' HG3' ' OH ' ' A' ' 56' ' ' TYR . 21.8 tp60 -69.48 84.36 0.41 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.103 0.561 . . . . 0.0 109.581 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.9 m -138.24 131.74 30.7 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.372 1.069 . . . . 0.0 109.146 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -140.76 132.57 27.46 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -120.88 129.48 53.52 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -174.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.4 p -132.14 149.53 32.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.841 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.2 p -94.98 105.78 17.72 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.0 tp -108.09 107.55 18.25 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.697 177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 26.9 m -32.92 120.49 0.35 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.86 1.264 . . . . 0.0 113.093 158.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.647 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.7 ptm180 -64.03 -13.61 48.22 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -172.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 44.5 p-10 -98.68 -14.22 19.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.163 0.985 . . . . 0.0 111.092 -179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 40.9 m -92.82 141.05 23.85 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.038 0.935 . . . . 0.0 110.124 -175.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.555 ' O ' HG22 ' A' ' 51' ' ' THR . 14.6 Cg_exo -61.12 149.33 89.69 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.313 2.675 . . . . 0.0 113.201 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.68 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.9 mm? -53.58 -29.86 39.37 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.036 -0.983 . . . . 0.0 112.336 172.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -54.89 -37.78 66.75 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.502 0.721 . . . . 0.0 112.307 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.555 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.4 t -69.42 -36.83 77.09 Favored 'General case' 0 CA--C 1.554 1.133 0 O-C-N 123.118 0.262 . . . . 0.0 110.58 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.01 -45.18 82.5 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.293 1.037 . . . . 0.0 110.531 175.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.495 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.3 mtt -54.94 -47.35 74.58 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.129 176.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 t -66.81 -33.79 76.4 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.01 -1.45 . . . . 0.0 110.463 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -67.29 -49.86 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.423 0.689 . . . . 0.0 110.159 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.449 ' CZ ' HG21 ' A' ' 95' ' ' VAL . 46.7 t80 -54.98 -60.77 2.91 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.167 0.987 . . . . 0.0 111.449 178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.51 ' HA ' HD23 ' A' ' 62' ' ' LEU . 11.4 pt-20 -62.7 -39.38 93.81 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.549 -173.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.78 -37.75 85.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 175.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.36 -45.05 76.51 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.426 ' HE2' ' HB2' ' A' ' 60' ' ' MET . 3.8 mpp? -109.6 36.54 2.92 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-O 120.831 0.348 . . . . 0.0 110.617 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 35.79 42.56 0.52 Allowed Glycine 0 N--CA 1.482 1.711 0 N-CA-C 118.326 2.09 . . . . 0.0 118.326 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 57' ' ' GLU . 2.8 mm? -72.35 88.45 1.18 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.902 0.851 . . . . 0.0 109.922 170.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -128.72 -20.5 3.54 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.378 0.671 . . . . 0.0 110.879 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.35 -32.16 71.82 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 174.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -137.36 145.65 43.58 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.032 0.933 . . . . 0.0 108.761 171.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -99.15 146.7 25.86 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 171.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.48 ' HB3' ' HA3' ' A' ' 97' ' ' GLY . 0.0 OUTLIER -126.51 152.7 46.15 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.575 0.75 . . . . 0.0 110.758 -172.258 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.427 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 50.0 m -89.46 162.62 15.64 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.105 -177.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.47 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 45.2 m-85 -132.27 128.12 37.13 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.489 1.116 . . . . 0.0 109.249 -174.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.523 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 31.6 m-85 -125.15 122.66 37.74 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.54 0.736 . . . . 0.0 110.636 -177.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.569 ' HB3' HD21 ' A' ' 76' ' ' LEU . 27.5 t80 -98.73 106.89 19.21 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.6 t70 52.01 46.11 27.15 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.259 1.023 . . . . 0.0 111.618 -171.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 76.5 1.03 69.28 Favored Glycine 0 C--N 1.347 1.175 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.907 178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 54.5 m -86.64 113.02 22.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.499 0.72 . . . . 0.0 109.303 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -59.02 115.4 3.12 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.818 0.698 . . . . 0.0 109.512 174.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 71' ' ' PHE . 56.6 mt -88.5 127.65 35.53 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.131 0.972 . . . . 0.0 108.863 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.4 t -81.44 -25.55 36.05 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.697 0.799 . . . . 0.0 111.422 -174.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.74 -47.86 1.0 Allowed Glycine 0 CA--C 1.525 0.679 0 C-N-CA 123.78 0.705 . . . . 0.0 112.436 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -93.97 11.28 30.19 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.665 0.786 . . . . 0.0 112.365 -168.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.558 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.1 pm0 -85.88 150.17 24.71 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 165.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.1 mt -102.26 160.37 26.57 Favored Pre-proline 0 C--N 1.309 -1.184 0 C-N-CA 124.806 1.242 . . . . 0.0 107.922 177.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.647 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 36.7 Cg_endo -67.22 -20.08 49.79 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 121.423 1.415 . . . . 0.0 111.839 171.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.88 92.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.4 0.68 . . . . 0.0 110.564 168.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -75.2 -45.46 40.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.038 0.935 . . . . 0.0 110.723 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.558 HD21 ' HG3' ' A' ' 80' ' ' GLU . 96.0 mt -68.66 -23.97 64.48 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.029 0.932 . . . . 0.0 112.783 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 71.53 64.51 2.71 Favored Glycine 0 C--N 1.346 1.128 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.68 ' HE1' HD11 ' A' ' 49' ' ' LEU . 30.7 ttp -128.39 153.78 46.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.35 1.06 . . . . 0.0 108.721 -173.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -149.49 167.18 26.96 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.598 0.759 . . . . 0.0 109.1 -170.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 46.9 m -55.71 117.85 4.02 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.463 0.705 . . . . 0.0 111.323 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 120.94 -21.79 8.24 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-O 119.816 -0.435 . . . . 0.0 113.245 177.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -58.32 169.29 0.89 Allowed 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 27.4 tp -133.61 110.51 9.95 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.348 -0.842 . . . . 0.0 108.917 -166.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.437 ' HB ' HG13 ' A' ' 30' ' ' VAL . 62.1 mt -95.46 150.29 4.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 114.555 -1.202 . . . . 0.0 108.415 175.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 34.9 mt-10 -109.96 165.06 12.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.038 0.935 . . . . 0.0 108.7 -171.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.593 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 46.0 t -139.89 109.49 3.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.6 0 C-N-CA 123.995 0.918 . . . . 0.0 108.912 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -119.34 99.92 6.99 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.574 1.149 . . . . 0.0 108.69 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.48 ' HA3' ' HB3' ' A' ' 67' ' ' LEU . . . . . . . . 0 C--O 1.249 1.071 0 N-CA-C 110.436 -1.066 . . . . 0.0 110.436 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.456 HG21 HE22 ' A' ' 24' ' ' GLN . 40.1 p . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -117.7 -35.94 3.81 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.868 0.867 . . . . 0.0 112.02 -171.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.2 p -70.25 121.6 17.91 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 118.311 -0.852 . . . . 0.0 108.853 177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -40.26 74.14 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 126.389 1.875 . . . . 0.0 115.487 -165.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.456 HE22 HG21 ' A' ' 20' ' ' THR . 9.1 tt0 -83.37 -35.14 25.35 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.811 2.044 . . . . 0.0 111.925 173.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.448 ' OE1' ' HB3' ' A' ' 42' ' ' SER . 3.9 pp0? -86.33 157.93 19.77 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.015 1.326 . . . . 0.0 112.892 -153.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.96 134.02 38.08 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.799 -160.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.62 103.37 15.76 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 171.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 45.2 mt -109.33 130.6 55.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.004 0.522 . . . . 0.0 109.935 -174.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -92.94 128.56 38.85 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 176.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.5 t -118.86 121.31 66.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 -173.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -127.62 137.44 52.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.773 0.429 . . . . 0.0 109.887 -171.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.609 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -76.46 173.18 54.41 Favored Glycine 0 C--N 1.343 0.942 0 O-C-N 123.745 0.653 . . . . 0.0 112.46 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -41.93 -37.48 1.33 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.827 0.851 . . . . 0.0 112.073 164.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.455 ' HG2' ' H ' ' A' ' 34' ' ' GLU . 4.6 pt-20 -87.87 117.56 26.8 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.966 1.307 . . . . 0.0 108.358 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -71.16 -21.01 62.23 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.224 0.61 . . . . 0.0 111.876 -173.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -63.27 -30.8 71.87 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.533 0.733 . . . . 0.0 110.177 173.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -76.38 90.4 3.23 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 172.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.1 m -126.73 126.31 43.25 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.534 0.734 . . . . 0.0 109.445 176.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.68 122.83 20.4 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -175.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -115.46 122.72 46.63 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 122.025 0.917 . . . . 0.0 109.355 -175.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.82 147.44 29.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.793 0 C-N-CA 125.045 1.338 . . . . 0.0 109.484 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.448 ' HB3' ' OE1' ' A' ' 25' ' ' GLN . 6.0 m -90.86 107.15 19.0 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 27.3 tp -104.71 131.61 51.95 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.749 0.82 . . . . 0.0 109.026 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 25.3 m -75.88 137.15 40.23 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.713 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 9.1 ptm180 -72.21 -6.79 45.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 120.742 0.306 . . . . 0.0 111.746 -175.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -92.4 -37.7 12.42 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.646 1.178 . . . . 0.0 109.887 172.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 31.4 m -78.01 132.55 67.06 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.599 0.76 . . . . 0.0 110.682 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.437 ' O ' HG22 ' A' ' 51' ' ' THR . 10.7 Cg_endo -64.54 162.07 32.6 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.545 2.163 . . . . 0.0 113.974 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.5 mm? -53.92 -28.03 34.32 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.433 179.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.83 -36.22 58.41 Favored 'General case' 0 CA--C 1.554 1.135 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -177.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 48' ' ' PRO . 10.9 t -73.26 -33.76 65.45 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 120.892 0.377 . . . . 0.0 111.129 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 tt -66.72 -42.7 85.92 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.258 1.023 . . . . 0.0 110.322 172.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.41 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.1 mtt -58.63 -49.36 77.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.558 1.143 . . . . 0.0 110.636 178.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 77.8 p -67.15 -32.84 74.22 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 124.813 1.321 . . . . 0.0 109.778 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -67.43 -53.5 28.52 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 122.845 0.458 . . . . 0.0 110.065 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -55.27 -60.16 3.79 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.613 1.165 . . . . 0.0 111.389 -178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 53' ' ' MET . 12.3 pt-20 -56.91 -49.87 74.28 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.015 0.822 . . . . 0.0 110.901 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.26 -27.1 66.04 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.46 -43.24 97.1 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -109.12 27.0 9.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 122.663 0.385 . . . . 0.0 111.097 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 42.73 65.29 1.4 Allowed Glycine 0 N--CA 1.48 1.63 0 N-CA-C 116.582 1.393 . . . . 0.0 116.582 -177.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -90.33 9.78 27.49 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.605 1.162 . . . . 0.0 110.504 173.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.9 p -62.79 97.75 0.11 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.072 0.949 . . . . 0.0 110.651 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.87 -43.86 0.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 -175.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 39.3 mtm180 -131.05 130.27 43.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 172.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -86.76 143.47 27.51 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -113.88 153.2 29.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.017 0.927 . . . . 0.0 109.998 -175.284 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 41.3 m -87.82 130.81 34.75 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.495 -173.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -101.64 133.05 46.94 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.121 0.969 . . . . 0.0 110.035 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.488 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 98.3 m-85 -128.73 132.39 47.97 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.306 0.642 . . . . 0.0 111.175 177.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.473 ' HB3' HD21 ' A' ' 76' ' ' LEU . 15.7 t80 -120.63 108.52 14.12 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 173.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.6 t70 59.5 26.22 15.15 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-O 122.045 0.926 . . . . 0.0 110.456 -172.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.75 -2.9 87.33 Favored Glycine 0 C--N 1.353 1.478 0 CA-C-N 115.517 -0.765 . . . . 0.0 114.272 -177.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.44 ' O ' ' HA ' ' A' ' 70' ' ' PHE . 90.9 m -73.51 125.92 29.04 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 117.581 0.69 . . . . 0.0 110.197 175.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -68.66 114.03 6.67 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 123.62 0.575 . . . . 0.0 109.64 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.473 HD21 ' HB3' ' A' ' 71' ' ' PHE . 12.2 mt -93.95 124.59 38.05 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 175.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 63.2 m -111.56 -14.19 13.71 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.31 -63.17 0.54 Allowed Glycine 0 C--N 1.345 1.065 0 N-CA-C 113.599 0.2 . . . . 0.0 113.599 176.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -77.8 -5.14 49.79 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -167.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.4 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.6 pm0 -81.43 147.63 29.67 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 48' ' ' PRO . 17.6 mt -99.6 153.16 37.91 Favored Pre-proline 0 C--N 1.312 -1.056 0 C-N-CA 125.343 1.457 . . . . 0.0 108.128 -176.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.713 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 50.0 Cg_endo -66.29 -36.23 28.74 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 121.768 1.645 . . . . 0.0 111.317 177.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.14 75.2 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.083 0.553 . . . . 0.0 110.966 174.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -65.94 -43.7 87.26 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.778 . . . . 0.0 110.624 175.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.4 HD21 ' HG3' ' A' ' 80' ' ' GLU . 50.6 mt -74.85 -24.83 58.65 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.63 0.772 . . . . 0.0 111.999 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 91.47 55.21 1.83 Allowed Glycine 0 C--N 1.343 0.919 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 -175.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 63.4 mtt -104.34 161.87 13.7 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.986 0.914 . . . . 0.0 110.653 178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 10.5 tp10 -148.9 160.42 43.27 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.928 0.891 . . . . 0.0 108.689 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 20.1 t -62.66 118.07 7.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.347 0.659 . . . . 0.0 110.72 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 99.34 41.19 3.04 Favored Glycine 0 C--N 1.34 0.771 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -173.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.5 t0 -103.9 -175.75 2.89 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.338 0.655 . . . . 0.0 109.444 -179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 30.9 tp -138.66 134.79 34.14 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.472 0.653 . . . . 0.0 109.447 -174.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 54.1 mt -126.54 150.39 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.923 1.289 . . . . 0.0 108.194 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.488 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 28.5 mt-10 -117.88 156.4 28.49 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 -171.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.609 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 10.2 t -140.14 139.41 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.567 0.747 . . . . 0.0 110.265 -174.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.1 m95 -135.73 95.08 3.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.812 1.245 . . . . 0.0 109.653 -175.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.3 0 CA-C-O 118.946 -0.919 . . . . 0.0 111.87 -176.786 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.484 1.227 0 CA-C-O 120.687 0.28 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -100.2 -12.63 19.41 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.417 0.687 . . . . 0.0 110.898 177.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.5 p -68.31 121.45 16.29 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -178.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -46.36 81.47 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.821 1.649 . . . . 0.0 114.738 -163.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.48 ' O ' ' HD2' ' A' ' 45' ' ' ARG . 1.3 pp0? -80.3 -38.15 31.33 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.396 -1.275 . . . . 0.0 107.869 165.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -89.53 154.33 20.09 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 113.849 -1.523 . . . . 0.0 110.303 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 82' ' ' PRO . 44.6 mt -99.01 123.36 43.25 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.35 -1.295 . . . . 0.0 108.306 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -87.28 101.87 13.95 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.632 HD13 ' SD ' ' A' ' 87' ' ' MET . 28.2 mt -113.55 154.7 26.68 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.498 0.719 . . . . 0.0 111.203 -168.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.6 mtm105 -112.19 136.28 51.8 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.188 0.595 . . . . 0.0 110.955 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -120.29 126.04 74.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.216 1.407 . . . . 0.0 108.899 173.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -129.12 129.16 44.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 -177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.622 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -89.98 175.11 41.36 Favored Glycine 0 C--N 1.344 0.991 0 O-C-N 123.729 0.643 . . . . 0.0 113.63 -172.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -39.66 -37.15 0.48 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.07 1.348 . . . . 0.0 113.932 167.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -75.09 122.61 23.82 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -63.84 -31.93 73.28 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.538 0.735 . . . . 0.0 111.987 -176.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -76.34 -26.65 55.97 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.447 0.699 . . . . 0.0 110.76 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.4 ' OE1' ' HB2' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -67.03 94.94 0.36 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.641 0.776 . . . . 0.0 109.173 -179.126 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.1 m -115.74 119.31 35.62 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 169.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.464 ' HB3' HG23 ' A' ' 30' ' ' VAL . 1.5 tm? -128.57 128.13 43.67 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 -178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -121.16 121.31 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 121.765 0.793 . . . . 0.0 109.542 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -128.15 144.83 36.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 124.817 1.247 . . . . 0.0 110.823 -171.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.9 p -93.39 112.17 24.02 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.814 0.845 . . . . 0.0 109.489 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.445 ' HB3' HD12 ' A' ' 28' ' ' LEU . 36.8 tp -110.09 133.9 52.73 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.924 0.889 . . . . 0.0 109.41 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 67.3 m -77.18 147.08 36.66 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.656 0.382 . . . . 0.0 109.992 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.496 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 8.9 ptm180 -64.62 -25.9 68.16 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.663 0.785 . . . . 0.0 111.853 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -99.69 -16.05 18.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.258 1.023 . . . . 0.0 111.096 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 44.2 m -88.42 135.99 32.08 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 123.701 0.8 . . . . 0.0 109.438 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.524 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 2.8 Cg_endo -65.9 155.03 71.47 Favored 'Trans proline' 0 C--N 1.373 1.865 0 C-N-CA 122.697 2.265 . . . . 0.0 113.283 -178.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -53.04 -29.9 32.53 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 125.137 1.375 . . . . 0.0 112.255 176.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.524 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 62.2 pttt -55.96 -35.47 66.74 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.0 t -70.3 -32.85 70.81 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 120.982 0.42 . . . . 0.0 110.748 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.0 tt -70.85 -37.6 73.12 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.599 1.16 . . . . 0.0 110.235 173.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 66.2 mtt -61.99 -42.09 98.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.01 0.924 . . . . 0.0 110.397 176.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.5 m -66.92 -38.58 86.47 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 124.534 1.146 . . . . 0.0 110.227 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.76 -45.6 70.98 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 122.989 0.516 . . . . 0.0 110.311 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.83 -57.96 9.86 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.219 1.008 . . . . 0.0 111.8 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.43 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 11.5 pt-20 -61.1 -42.51 98.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 123.946 0.779 . . . . 0.0 110.512 -174.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.58 -29.48 70.08 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 177.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.41 -51.68 66.06 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -109.18 29.83 7.15 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 122.469 0.308 . . . . 0.0 111.416 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 44.97 64.79 2.04 Favored Glycine 0 N--CA 1.485 1.917 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.43 ' HB2' ' HB2' ' A' ' 57' ' ' GLU . 3.9 mm? -91.19 20.44 5.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.302 1.041 . . . . 0.0 111.471 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.6 p -74.25 82.38 1.85 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 121.449 0.642 . . . . 0.0 109.743 174.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.49 -27.89 1.5 Allowed Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.197 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -126.46 95.46 4.37 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.33 1.052 . . . . 0.0 108.32 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -89.41 142.98 27.18 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.557 0.343 . . . . 0.0 110.233 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -129.82 162.03 29.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.525 1.13 . . . . 0.0 110.85 -170.587 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 67.0 m -98.16 168.09 10.47 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.253 0.621 . . . . 0.0 111.156 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -130.99 132.12 44.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.159 1.383 . . . . 0.0 109.007 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -127.73 112.4 14.76 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.753 0.821 . . . . 0.0 110.603 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.531 ' HB3' HD21 ' A' ' 76' ' ' LEU . 10.8 t80 -102.23 111.72 24.11 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.677 1.191 . . . . 0.0 107.819 174.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.4 t70 52.47 36.16 19.52 Favored 'General case' 0 CA--C 1.564 1.495 0 CA-C-O 121.977 0.894 . . . . 0.0 110.836 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 85.75 -16.12 43.21 Favored Glycine 0 N--CA 1.478 1.466 0 CA-C-N 115.062 -0.972 . . . . 0.0 114.745 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 64.5 m -70.51 121.0 16.99 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.287 0.635 . . . . 0.0 110.789 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -71.23 119.71 15.75 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.531 HD21 ' HB3' ' A' ' 71' ' ' PHE . 45.0 mt -91.37 126.82 36.58 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 124.289 1.036 . . . . 0.0 109.403 -177.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.7 m -90.35 -22.97 21.25 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.892 0.877 . . . . 0.0 112.38 -176.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.21 -49.72 0.92 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-O 120.103 -0.276 . . . . 0.0 113.604 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.4 mtm180 -82.54 1.29 38.64 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.703 0.801 . . . . 0.0 112.866 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.422 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -85.26 148.12 26.22 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 172.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.2 mt -100.4 156.8 34.82 Favored Pre-proline 0 C--N 1.313 -1.0 0 C-N-CA 125.045 1.338 . . . . 0.0 108.097 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 73.7 Cg_endo -69.32 -25.06 31.01 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 121.531 1.487 . . . . 0.0 111.126 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.48 83.97 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.324 0.649 . . . . 0.0 110.56 171.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -67.11 -40.5 86.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.422 ' HB3' ' CE2' ' A' ' 71' ' ' PHE . 88.5 mt -73.55 -23.61 60.0 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.198 0.999 . . . . 0.0 111.902 176.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.78 23.68 52.11 Favored Glycine 0 C--N 1.349 1.288 0 O-C-N 123.236 0.335 . . . . 0.0 112.858 -176.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.632 ' SD ' HD13 ' A' ' 28' ' ' LEU . 32.8 ttm -73.85 160.66 31.11 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.388 1.475 . . . . 0.0 110.848 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -140.04 157.19 46.04 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.094 0.957 . . . . 0.0 109.548 -176.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.5 m -56.45 119.49 6.13 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.358 0.663 . . . . 0.0 111.119 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 109.46 -15.37 32.47 Favored Glycine 0 N--CA 1.475 1.262 0 CA-C-O 119.727 -0.485 . . . . 0.0 113.91 179.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.64 175.85 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.54 1.136 . . . . 0.0 112.561 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 59.4 tp -130.79 107.66 9.3 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -172.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 37.1 mt -89.75 149.85 3.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 168.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -115.79 163.45 15.82 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.622 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 98.8 t -135.76 119.61 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 -178.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -130.04 111.17 12.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.362 1.065 . . . . 0.0 109.333 -176.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.099 0 CA-C-O 119.263 -0.743 . . . . 0.0 113.127 -176.363 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 t . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.574 0.702 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.57 -40.97 0.87 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.154 0.982 . . . . 0.0 110.552 -169.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -90.31 123.15 33.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.402 1.081 . . . . 0.0 108.149 170.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 18.4 m -67.72 70.95 0.13 Allowed 'General case' 0 CA--C 1.565 1.522 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -171.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -81.43 -36.15 29.79 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.613 1.565 . . . . 0.0 108.225 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -87.37 156.12 19.74 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 113.369 -1.741 . . . . 0.0 111.941 -162.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.9 mt -92.71 128.39 38.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.26 -163.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -83.85 99.82 10.57 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.479 HD13 ' SD ' ' A' ' 87' ' ' MET . 64.9 mt -110.89 130.77 55.49 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.868 0.867 . . . . 0.0 109.63 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtm180 -99.15 112.11 24.33 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.018 0.527 . . . . 0.0 109.855 -176.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -100.48 119.65 48.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.914 0.886 . . . . 0.0 109.435 176.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -123.27 134.69 54.07 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -174.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.44 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -65.96 157.15 49.03 Favored Glycine 0 C--N 1.352 1.42 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 173.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.2 pttm -53.64 -20.76 5.68 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 118.037 0.919 . . . . 0.0 112.299 173.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -70.59 108.92 4.58 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 163.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -58.91 -33.21 70.29 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -167.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 26.6 p80 -84.84 -11.67 55.19 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.09 104.58 7.66 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 173.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 40.8 m -121.72 128.73 52.12 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.151 0.98 . . . . 0.0 109.964 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -129.44 121.06 26.54 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 175.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -113.24 125.3 54.16 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 121.286 0.565 . . . . 0.0 109.72 -176.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.1 p -132.34 148.39 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.736 1.214 . . . . 0.0 110.599 -174.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.4 p -102.29 105.24 15.84 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.464 ' HB3' HD12 ' A' ' 28' ' ' LEU . 34.2 tp -91.53 135.84 33.56 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.573 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 19.4 m -74.19 136.69 42.81 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.468 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 10.7 ptm180 -71.51 -15.82 62.32 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -168.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.408 ' O ' HD22 ' A' ' 81' ' ' LEU . 28.8 t70 -92.67 -36.73 12.79 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.988 0.915 . . . . 0.0 110.336 172.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -66.71 143.0 97.88 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 123.545 0.738 . . . . 0.0 111.249 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.457 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -71.62 162.74 41.2 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.616 2.211 . . . . 0.0 113.1 176.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.2 mm? -56.06 -26.12 47.98 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.731 175.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.457 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 62.2 pttt -58.32 -37.53 75.27 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -178.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.44 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.2 t -70.56 -30.77 67.58 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 118.439 0.563 . . . . 0.0 110.82 178.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.99 -40.74 78.58 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.176 0.991 . . . . 0.0 110.428 172.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.41 -45.13 89.02 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.283 1.033 . . . . 0.0 110.046 175.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -66.28 -35.95 81.72 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 124.993 1.433 . . . . 0.0 110.703 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -68.88 -47.43 65.88 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.097 0.559 . . . . 0.0 110.258 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -54.36 -59.05 5.19 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.473 1.109 . . . . 0.0 111.819 177.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 53' ' ' MET . 10.5 pt-20 -62.54 -46.6 87.64 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.349 1.03 . . . . 0.0 111.401 -174.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -65.54 -34.53 78.47 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.28 76.06 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.491 0.716 . . . . 0.0 112.301 178.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 64.6 mtm -112.59 29.12 8.2 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.123 0.569 . . . . 0.0 111.743 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 41.77 67.76 0.78 Allowed Glycine 0 CA--C 1.545 1.909 0 N-CA-C 116.299 1.28 . . . . 0.0 116.299 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 57' ' ' GLU . 4.2 mm? -90.53 47.82 1.47 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.548 0.739 . . . . 0.0 111.093 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.0 p -71.18 124.44 24.47 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.397 174.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.43 -63.42 4.15 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 111.477 -0.649 . . . . 0.0 111.477 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -68.34 90.44 0.36 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.299 0.639 . . . . 0.0 110.19 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tppt? -101.57 147.37 26.48 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.41 HD11 ' HG ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -128.91 169.23 14.88 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.172 0.989 . . . . 0.0 111.21 -166.7 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.5 m -104.71 166.36 10.44 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.031 0.932 . . . . 0.0 110.451 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.427 ' HB3' HD12 ' A' ' 76' ' ' LEU . 65.2 m-85 -136.08 129.65 32.2 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.883 1.273 . . . . 0.0 108.722 -179.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.73 133.93 50.77 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.584 0.753 . . . . 0.0 111.023 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.466 ' HB3' HD21 ' A' ' 76' ' ' LEU . 54.2 t80 -129.13 116.61 19.49 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.533 1.133 . . . . 0.0 108.292 171.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.5 t70 59.05 30.47 20.28 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.492 1.117 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 87.68 -19.78 31.25 Favored Glycine 0 C--N 1.349 1.268 0 CA-C-N 115.651 -0.704 . . . . 0.0 113.37 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 13.8 m -65.29 120.14 12.21 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.621 0.768 . . . . 0.0 110.494 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -68.88 113.52 6.38 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 71' ' ' PHE . 31.7 mt -82.62 119.44 24.28 Favored 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -85.94 -31.02 22.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.366 1.066 . . . . 0.0 112.315 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.7 10.49 23.04 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.803 -172.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -123.54 10.46 9.12 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.538 1.135 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -112.45 148.08 35.15 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.408 HD22 ' O ' ' A' ' 46' ' ' ASP . 14.7 mt -102.21 156.65 34.98 Favored Pre-proline 0 C--N 1.313 -0.991 0 C-N-CA 125.37 1.468 . . . . 0.0 107.767 177.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.5 Cg_endo -67.57 -21.43 46.03 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.407 1.405 . . . . 0.0 110.894 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.2 76.25 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.017 0.927 . . . . 0.0 110.719 170.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.08 -42.35 89.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.016 0.926 . . . . 0.0 111.431 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 91.8 mt -74.18 -24.47 59.38 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.794 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 76.37 68.7 1.49 Allowed Glycine 0 C--N 1.351 1.374 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 -173.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.479 ' SD ' HD13 ' A' ' 28' ' ' LEU . 43.8 ttm -118.65 160.19 22.26 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.47 1.108 . . . . 0.0 109.8 -172.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -124.03 166.14 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.275 0.63 . . . . 0.0 109.986 -175.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.4 t -76.63 15.22 0.66 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.172 0.989 . . . . 0.0 113.174 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -151.94 55.98 0.45 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -103.71 -175.05 2.69 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.714 -0.743 . . . . 0.0 109.033 -173.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.4 tp -143.84 107.38 4.61 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 63.5 mt -94.22 150.09 4.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 114.251 -1.341 . . . . 0.0 108.903 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -105.6 158.25 16.82 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.44 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.2 t -136.87 124.46 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -124.82 99.27 6.07 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.618 0.767 . . . . 0.0 109.695 -176.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 177.005 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.77 0.319 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -99.35 -37.04 9.4 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.984 0.913 . . . . 0.0 109.246 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.5 t -110.39 121.53 45.52 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 169.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.0 m -81.85 70.2 8.7 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -79.5 -38.84 33.47 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 162.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -124.97 151.64 45.22 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 114.475 -1.239 . . . . 0.0 109.307 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 40.6 mt -107.32 134.84 49.81 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.918 1.287 . . . . 0.0 108.626 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -83.06 101.36 11.08 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 43' ' ' LEU . 90.3 mt -110.51 124.21 51.38 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 122.956 0.502 . . . . 0.0 111.225 -170.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -87.68 138.12 31.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.188 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.57 124.49 65.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 125.238 1.415 . . . . 0.0 108.103 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -122.97 129.05 51.05 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -175.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.668 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -74.74 172.86 52.58 Favored Glycine 0 C--N 1.342 0.877 0 N-CA-C 114.739 0.656 . . . . 0.0 114.739 -176.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -36.03 -39.89 0.18 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.129 1.372 . . . . 0.0 112.453 157.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -81.67 99.12 8.72 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -68.04 -22.45 64.96 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -171.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 37.9 t-80 -70.18 -28.73 65.55 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.904 0.882 . . . . 0.0 110.523 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -71.9 112.63 8.16 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.205 0.602 . . . . 0.0 109.401 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 39.8 m -128.04 126.32 41.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.737 0.815 . . . . 0.0 108.894 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -128.01 136.86 51.84 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -125.23 128.27 48.04 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.055 0.843 . . . . 0.0 110.272 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -133.96 144.25 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.451 1.1 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.2 m -94.14 107.23 19.17 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 28' ' ' LEU . 43.1 tp -93.48 134.97 35.18 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.009 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.3 m -77.68 141.2 39.52 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.457 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.1 ptm180 -63.4 -26.05 68.57 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -172.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.15 -15.98 24.15 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.784 0.834 . . . . 0.0 110.621 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.0 m -88.74 132.84 37.28 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 177.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.489 ' O ' HG22 ' A' ' 51' ' ' THR . 1.0 OUTLIER -69.0 163.61 37.0 Favored 'Trans proline' 0 C--N 1.369 1.62 0 C-N-CA 122.484 2.122 . . . . 0.0 113.359 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.43 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.1 mm? -57.26 -26.37 60.69 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.882 177.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.432 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 59.5 pttt -58.62 -36.89 74.78 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.3 t -72.56 -30.42 64.4 Favored 'General case' 0 CA--C 1.554 1.118 0 CA-C-O 120.924 0.392 . . . . 0.0 110.661 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -71.7 -40.32 69.59 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.262 1.025 . . . . 0.0 110.304 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.486 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 63.4 mtt -56.37 -43.88 79.63 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.234 1.013 . . . . 0.0 110.462 173.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.0 t -64.1 -41.61 97.21 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 124.955 1.409 . . . . 0.0 109.837 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -66.91 -46.01 76.16 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.221 0.608 . . . . 0.0 110.962 -174.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.12 -60.85 2.91 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.699 0.8 . . . . 0.0 111.692 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 53' ' ' MET . 7.2 pt-20 -59.55 -40.6 87.83 Favored 'General case' 0 N--CA 1.482 1.132 0 O-C-N 123.91 0.757 . . . . 0.0 111.786 -176.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -64.97 -40.26 94.73 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.8 86.45 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.674 0.789 . . . . 0.0 112.388 -179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.728 ' HG3' HD23 ' A' ' 62' ' ' LEU . 20.0 ptp -110.02 27.95 9.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.439 0.695 . . . . 0.0 112.145 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 34.99 66.9 0.31 Allowed Glycine 0 CA--C 1.54 1.6 0 N-CA-C 116.621 1.409 . . . . 0.0 116.621 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.728 HD23 ' HG3' ' A' ' 60' ' ' MET . 2.0 mm? -89.83 69.57 7.57 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.749 0.785 . . . . 0.0 110.177 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.6 p -100.9 109.19 21.11 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.618 176.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.93 -83.4 0.23 Allowed Glycine 0 C--N 1.341 0.824 0 N-CA-C 110.377 -1.089 . . . . 0.0 110.377 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -82.35 134.21 35.25 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.44 ' HE3' ' HA ' ' A' ' 66' ' ' LYS . 0.8 OUTLIER -105.73 154.28 20.68 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.922 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.413 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.67 155.39 45.11 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.813 0.845 . . . . 0.0 111.144 -168.387 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.453 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 56.4 m -104.49 169.09 8.67 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.138 0.975 . . . . 0.0 109.885 176.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 18.4 m-85 -130.73 132.19 45.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.266 1.027 . . . . 0.0 109.0 -176.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -127.76 121.87 31.35 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.852 0.861 . . . . 0.0 111.023 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.544 ' HB3' HD21 ' A' ' 76' ' ' LEU . 42.7 t80 -102.43 109.79 21.55 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 52.92 40.9 31.75 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.385 1.074 . . . . 0.0 111.087 -171.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 73.94 4.23 66.53 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-N 115.051 -0.977 . . . . 0.0 114.838 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 94.4 m -81.24 120.88 25.46 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.77 0.785 . . . . 0.0 109.185 173.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.453 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 3.1 tmtp? -69.42 113.12 6.44 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.544 HD21 ' HB3' ' A' ' 71' ' ' PHE . 33.5 mt -83.64 116.66 22.73 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.8 m -71.66 -27.31 62.98 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.844 0.858 . . . . 0.0 111.4 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 127.97 -44.38 1.24 Allowed Glycine 0 C--N 1.346 1.103 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.376 -177.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -80.47 -1.22 40.75 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -171.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -76.25 148.31 37.7 Favored 'General case' 0 C--N 1.347 0.467 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 176.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -102.87 149.86 37.22 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.998 1.319 . . . . 0.0 107.779 174.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 53.5 Cg_endo -66.5 -25.78 47.77 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 121.575 1.517 . . . . 0.0 111.298 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.21 96.99 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.664 0.786 . . . . 0.0 111.133 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.05 -43.48 74.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.761 0.825 . . . . 0.0 111.221 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 76.7 mt -72.17 -19.82 61.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.716 0.806 . . . . 0.0 111.757 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.94 51.24 5.93 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.521 ' SD ' HD13 ' A' ' 28' ' ' LEU . 41.7 ttm -106.36 156.55 18.4 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.831 1.252 . . . . 0.0 109.137 -174.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.9 tt0 -139.47 160.06 40.71 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.004 0.521 . . . . 0.0 110.89 -170.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.7 m -61.85 117.78 6.33 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.232 0.613 . . . . 0.0 110.333 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.15 48.77 4.47 Favored Glycine 0 C--N 1.338 0.676 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.6 t0 -102.87 -160.89 0.81 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 34.8 tp -142.75 109.79 5.57 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.624 0.726 . . . . 0.0 109.042 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.505 HD11 HD13 ' A' ' 28' ' ' LEU . 45.2 mt -101.0 148.35 7.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 167.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -115.56 162.02 17.8 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 -174.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.668 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 24.6 t -138.41 103.92 2.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -113.02 108.21 17.02 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.238 0.615 . . . . 0.0 110.206 -174.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.957 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 178.603 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.4 m . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -31.54 11.65 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.681 0.792 . . . . 0.0 110.466 -176.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.0 t -91.04 114.56 27.12 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -81.15 70.58 8.01 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -167.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -80.93 -38.91 27.05 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 159.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -128.16 147.42 50.56 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 124.877 1.271 . . . . 0.0 108.947 165.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -117.3 151.84 36.12 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.09 1.356 . . . . 0.0 108.729 -174.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -99.19 103.96 15.88 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.531 HD12 ' HB3' ' A' ' 91' ' ' ASP . 2.2 mm? -100.56 127.91 46.78 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.511 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 93.1 mtt180 -92.5 105.14 17.37 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.164 0.586 . . . . 0.0 110.25 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -99.37 118.24 45.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.155 -172.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.456 ' NE2' HD11 ' A' ' 92' ' ' LEU . 26.7 mt-30 -125.6 128.26 47.62 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.013 0.525 . . . . 0.0 110.58 -170.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.686 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -82.02 162.86 42.99 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 123.58 0.55 . . . . 0.0 113.625 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -58.7 -17.08 19.72 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.884 0.874 . . . . 0.0 112.371 168.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.408 ' HB2' ' HB2' ' A' ' 37' ' ' GLN . 43.5 mm-40 -74.48 132.97 42.35 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -64.45 -34.18 77.6 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -169.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -99.31 16.19 23.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.295 0.638 . . . . 0.0 111.695 178.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.408 ' HB2' ' HB2' ' A' ' 34' ' ' GLU . 24.1 tp60 -99.26 95.63 7.2 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.117 0.484 . . . . 0.0 110.386 177.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.407 HG23 ' HG2' ' A' ' 31' ' ' GLN . 86.9 m -127.43 129.86 48.26 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 166.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.1 tp -130.64 152.34 50.11 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.511 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.7 pt-20 -133.04 132.29 41.65 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 164.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -134.25 148.57 29.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 123.779 0.832 . . . . 0.0 109.662 -177.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 m -92.08 109.4 20.76 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.275 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HB3' HD23 ' A' ' 28' ' ' LEU . 56.7 tp -105.75 133.08 51.06 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.925 177.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.7 m -77.44 146.64 36.4 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 15.0 ptm180 -66.57 -20.76 66.09 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.324 0.65 . . . . 0.0 112.161 -174.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.75 -18.51 22.84 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.399 1.08 . . . . 0.0 110.899 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.0 m -93.5 126.1 51.43 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 123.712 0.805 . . . . 0.0 109.542 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.48 ' HG2' ' HE2' ' A' ' 50' ' ' LYS . 9.9 Cg_endo -65.98 164.41 27.45 Favored 'Trans proline' 0 C--N 1.381 2.268 0 C-N-CA 122.138 1.892 . . . . 0.0 113.826 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.472 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.4 mm? -59.94 -25.92 65.55 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.106 -177.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HE2' ' HG2' ' A' ' 48' ' ' PRO . 65.0 pttt -57.34 -38.03 73.47 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 48' ' ' PRO . 14.3 t -70.45 -31.31 68.42 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 117.819 0.281 . . . . 0.0 110.53 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -69.47 -42.12 75.27 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.231 1.012 . . . . 0.0 110.276 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -56.96 -44.89 83.05 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.424 1.089 . . . . 0.0 110.505 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.8 m -67.56 -39.14 84.93 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 113.89 -1.505 . . . . 0.0 110.134 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -65.17 -45.87 83.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.968 0.507 . . . . 0.0 110.164 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -55.9 -60.36 3.58 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.78 1.232 . . . . 0.0 111.722 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.77 -38.09 86.72 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.584 -177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -65.9 -35.32 80.31 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 121.868 -0.52 . . . . 0.0 111.89 175.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.97 -42.29 99.79 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.461 0.704 . . . . 0.0 112.798 -177.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -106.46 28.64 7.6 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.099 0.56 . . . . 0.0 111.543 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 43.89 38.78 4.67 Favored Glycine 0 N--CA 1.478 1.492 0 N-CA-C 116.355 1.302 . . . . 0.0 116.355 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.4 mt -81.88 67.93 8.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.186 0.994 . . . . 0.0 108.69 175.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.8 m -98.5 128.95 45.06 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.314 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.55 -53.2 2.71 Favored Glycine 0 C--N 1.344 0.975 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -172.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -74.59 93.79 2.56 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 168.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -90.72 141.9 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 166.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.409 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -125.09 160.42 29.11 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.601 1.16 . . . . 0.0 109.638 -173.789 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.446 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 39.0 m -87.11 159.89 18.75 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.377 0.671 . . . . 0.0 111.241 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.83 129.14 40.06 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.068 0.947 . . . . 0.0 109.332 -176.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -128.87 143.1 50.81 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.03 0.932 . . . . 0.0 111.69 -176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.576 ' HB3' HD21 ' A' ' 76' ' ' LEU . 16.2 t80 -133.67 104.32 6.29 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.914 1.685 . . . . 0.0 107.845 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t70 55.18 30.45 14.54 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 122.519 1.152 . . . . 0.0 111.841 -174.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 88.3 -3.66 85.42 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 114.94 -1.027 . . . . 0.0 113.679 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 61.0 m -75.54 113.94 13.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.442 0.697 . . . . 0.0 109.596 174.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -66.88 113.59 5.05 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 173.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 71' ' ' PHE . 38.8 mt -78.94 112.19 15.88 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.252 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.0 m -78.95 -26.65 43.56 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.94 0.896 . . . . 0.0 112.672 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.04 -45.73 1.1 Allowed Glycine 0 C--N 1.339 0.727 0 CA-C-N 116.575 -0.284 . . . . 0.0 112.618 -178.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.16 4.83 44.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 111.431 -164.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.2 pm0 -91.75 147.99 22.58 Favored 'General case' 0 C--N 1.343 0.302 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.5 mt -98.2 156.21 36.09 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 125.71 1.604 . . . . 0.0 109.108 179.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.565 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 54.6 Cg_endo -66.76 -23.95 47.79 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 121.546 1.498 . . . . 0.0 111.485 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -72.35 -37.52 68.81 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.677 0.791 . . . . 0.0 111.188 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -62.63 -42.47 99.61 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.805 0.842 . . . . 0.0 110.48 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.505 HD21 ' HG3' ' A' ' 80' ' ' GLU . 76.8 mt -79.25 -24.0 43.3 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.81 0.844 . . . . 0.0 111.348 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 73.64 64.8 2.38 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 111.769 -0.532 . . . . 0.0 111.769 -175.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 70.2 mtp -106.87 170.85 7.7 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.9 0.88 . . . . 0.0 110.391 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.454 ' H ' ' HB2' ' A' ' 91' ' ' ASP . 39.1 tt0 -126.83 169.51 13.15 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.958 0.903 . . . . 0.0 109.954 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.2 m -75.1 11.78 1.06 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.787 0.835 . . . . 0.0 112.503 177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -148.58 46.77 0.67 Allowed Glycine 0 C--N 1.34 0.797 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 173.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.531 ' HB3' HD12 ' A' ' 28' ' ' LEU . 7.2 t70 -93.04 176.64 6.34 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.456 HD11 ' NE2' ' A' ' 31' ' ' GLN . 28.6 tp -131.4 118.88 20.87 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -172.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 44.6 mt -106.63 147.24 12.2 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 170.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -124.54 155.67 38.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.559 -1.275 . . . . 0.0 107.559 -175.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.686 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 11.6 t -135.12 126.76 46.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 C-N-CA 123.343 0.657 . . . . 0.0 109.242 -171.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -130.56 94.74 3.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.246 1.018 . . . . 0.0 109.395 -174.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.127 0 CA-C-O 118.328 -1.262 . . . . 0.0 110.893 176.399 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -140.61 -47.5 0.42 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.246 0.218 . . . . 0.0 110.56 172.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -114.24 79.27 1.24 Allowed 'General case' 0 C--O 1.243 0.73 0 C-N-CA 124.038 0.935 . . . . 0.0 109.136 162.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -100.95 66.28 1.15 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 122.291 1.043 . . . . 0.0 110.914 177.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -81.72 -39.52 24.11 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 114.086 -1.415 . . . . 0.0 107.219 150.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.529 ' NE2' ' HB2' ' A' ' 42' ' ' SER . 19.4 pt20 -130.45 153.07 49.16 Favored 'General case' 0 C--N 1.349 0.555 0 CA-C-N 113.968 -1.469 . . . . 0.0 110.126 -176.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' A' ' 82' ' ' PRO . 57.5 mt -110.59 135.11 51.73 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.778 1.231 . . . . 0.0 108.577 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 67.5 mm-40 -90.8 103.84 16.5 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 35.3 mt -109.65 132.97 53.65 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 122.185 -0.322 . . . . 0.0 110.329 -171.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -95.2 140.68 29.78 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -129.7 132.37 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -173.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -135.84 141.94 44.74 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.065 0.393 . . . . 0.0 110.866 -175.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.687 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -81.15 172.28 53.96 Favored Glycine 0 C--N 1.347 1.141 0 O-C-N 123.683 0.615 . . . . 0.0 113.306 177.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -41.38 -32.23 0.3 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 124.628 1.171 . . . . 0.0 112.729 165.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.494 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 0.8 OUTLIER -94.79 113.81 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 163.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -67.87 -20.26 65.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.087 0.555 . . . . 0.0 112.151 -173.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -63.36 -27.88 69.61 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.825 0.85 . . . . 0.0 110.528 174.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.494 ' HB2' ' HG2' ' A' ' 34' ' ' GLU . 5.3 tp-100 -76.43 87.75 3.19 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.6 m -119.02 130.25 55.56 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.094 0.558 . . . . 0.0 110.77 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.57 121.16 18.35 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.33 1.052 . . . . 0.0 108.204 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -105.11 116.23 31.59 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -123.6 144.95 31.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 123.992 0.917 . . . . 0.0 110.251 -173.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.529 ' HB2' ' NE2' ' A' ' 25' ' ' GLN . 25.8 p -91.19 110.02 21.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.853 0.861 . . . . 0.0 109.004 179.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 44.6 tp -109.59 134.16 52.26 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.735 0.814 . . . . 0.0 108.813 177.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 57.4 m -73.57 142.77 46.62 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 176.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.542 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 35.5 ptt180 -62.49 -27.64 69.28 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.2 0.6 . . . . 0.0 112.13 -173.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -95.92 -9.94 30.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.729 0.811 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 44' ' ' SER . 66.4 m -90.13 139.67 27.24 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 123.681 0.793 . . . . 0.0 109.443 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.59 ' HB2' ' HG2' ' A' ' 50' ' ' LYS . 7.2 Cg_exo -65.88 157.45 59.06 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.872 2.381 . . . . 0.0 113.093 -177.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.6 mm? -58.11 -27.8 64.06 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.519 173.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.59 ' HG2' ' HB2' ' A' ' 48' ' ' PRO . 61.2 pttt -58.09 -38.07 75.7 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 118.604 0.638 . . . . 0.0 112.608 -177.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.473 HG22 ' O ' ' A' ' 48' ' ' PRO . 13.2 t -72.49 -29.39 63.6 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 120.817 0.341 . . . . 0.0 110.454 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.6 tt -69.72 -42.52 73.9 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.885 0.874 . . . . 0.0 110.099 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.5 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -56.9 -46.86 81.64 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.344 1.058 . . . . 0.0 110.51 177.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 29.7 t -64.36 -35.57 81.32 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.404 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -68.7 -46.32 69.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.381 0.672 . . . . 0.0 110.216 -178.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -57.39 -60.15 4.08 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.359 1.064 . . . . 0.0 111.823 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.15 -32.81 73.46 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.84 0.712 . . . . 0.0 111.787 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -73.44 -38.54 65.48 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.23 -50.06 75.45 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.724 0.81 . . . . 0.0 112.669 -175.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.622 ' HG3' HD23 ' A' ' 62' ' ' LEU . 17.9 ptp -100.08 30.51 3.73 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.467 -176.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 46.18 36.63 7.4 Favored Glycine 0 CA--C 1.536 1.363 0 N-CA-C 116.417 1.327 . . . . 0.0 116.417 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.622 HD23 ' HG3' ' A' ' 60' ' ' MET . 3.9 mm? -86.3 9.92 16.38 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.251 0.621 . . . . 0.0 110.571 170.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 p -59.99 102.35 0.16 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.15 0.98 . . . . 0.0 110.262 172.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.37 -57.66 0.71 Allowed Glycine 0 C--N 1.347 1.156 0 N-CA-C 110.398 -1.081 . . . . 0.0 110.398 -174.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -88.72 98.49 11.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -85.2 141.83 29.87 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 118.257 0.48 . . . . 0.0 110.587 -178.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.422 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -127.6 158.88 36.3 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.321 1.048 . . . . 0.0 110.127 -175.298 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.483 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 21.3 m -86.57 162.32 18.07 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.406 0.683 . . . . 0.0 111.243 -178.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -131.22 126.76 36.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.394 1.078 . . . . 0.0 109.152 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.431 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 9.6 m-85 -123.44 151.29 42.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.618 0.767 . . . . 0.0 110.762 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.577 ' HB3' HD21 ' A' ' 76' ' ' LEU . 22.2 t80 -137.25 114.11 10.52 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 172.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.8 25.68 15.21 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.794 0.838 . . . . 0.0 110.824 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 78.03 4.46 86.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 115.981 -0.554 . . . . 0.0 113.561 -174.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.0 m -82.82 120.2 25.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.785 0.834 . . . . 0.0 109.066 175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.3 tmtp? -68.12 115.29 7.44 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.577 HD21 ' HB3' ' A' ' 71' ' ' PHE . 44.4 mt -81.97 112.06 18.71 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.0 t -71.87 -34.22 69.03 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.767 0.827 . . . . 0.0 111.979 -173.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.86 -9.43 11.43 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-N 116.009 -0.541 . . . . 0.0 113.356 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -109.82 10.97 24.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.514 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.4 pm0 -101.74 147.92 25.89 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 173.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 23.2 mt -98.86 156.26 35.74 Favored Pre-proline 0 C--N 1.312 -1.023 0 C-N-CA 125.183 1.393 . . . . 0.0 108.683 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.542 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 49.4 Cg_endo -65.38 -33.02 49.15 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.799 1.666 . . . . 0.0 111.072 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.16 79.64 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.848 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.49 -42.93 77.95 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.935 0.894 . . . . 0.0 111.683 178.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.514 HD21 ' HG3' ' A' ' 80' ' ' GLU . 85.0 mt -70.95 -22.98 62.15 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.447 0.699 . . . . 0.0 111.293 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 99.06 17.67 26.79 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.724 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 60.3 mtt -71.06 166.9 20.41 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.777 0.831 . . . . 0.0 111.627 177.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -166.19 2.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.197 0.999 . . . . 0.0 109.67 175.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.7 m -78.64 12.83 1.87 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -165.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -162.09 63.23 0.27 Allowed Glycine 0 C--N 1.352 1.426 0 CA-C-N 118.245 0.475 . . . . 0.0 112.22 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -97.44 -168.65 1.72 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.693 0.397 . . . . 0.0 110.038 -170.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.3 tp -139.83 127.5 21.78 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.827 0.851 . . . . 0.0 109.23 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 40.4 mt -121.2 152.63 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 124.935 1.294 . . . . 0.0 108.448 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.431 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 30.8 mt-10 -114.04 160.73 18.56 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.793 1.237 . . . . 0.0 107.899 -173.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.687 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 9.4 t -137.26 107.88 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.85 0.86 . . . . 0.0 109.034 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -105.29 94.76 5.4 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.218 1.007 . . . . 0.0 108.656 -176.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.464 0 CA-C-O 118.547 -1.141 . . . . 0.0 111.773 -178.035 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -99.5 -43.57 6.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.23 0.612 . . . . 0.0 110.908 -175.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.9 t -110.48 92.43 4.04 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-O 121.824 0.821 . . . . 0.0 110.729 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -101.85 70.25 1.23 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.409 0.684 . . . . 0.0 109.786 170.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -74.6 -60.24 2.37 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 170.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.516 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 4.3 pp0? -119.97 142.7 48.53 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 167.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.405 HD22 ' HB2' ' A' ' 82' ' ' PRO . 6.6 mp -102.73 125.21 49.38 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.149 1.38 . . . . 0.0 109.437 -166.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -80.07 100.53 8.24 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 176.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 53.7 mt -114.13 128.86 56.57 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.767 0.427 . . . . 0.0 110.049 -174.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -95.33 132.05 40.76 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -123.17 129.42 74.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -174.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 37' ' ' GLN . 28.6 mt-30 -129.55 130.59 45.95 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -175.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.613 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -82.31 -173.8 49.26 Favored Glycine 0 C--N 1.346 1.11 0 O-C-N 123.368 0.417 . . . . 0.0 113.335 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -30.96 -45.9 0.08 Allowed 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 124.947 1.299 . . . . 0.0 112.392 161.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.95 113.33 21.32 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 167.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -70.2 -19.78 63.15 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.475 0.31 . . . . 0.0 110.555 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.04 -33.32 75.49 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 124.06 0.944 . . . . 0.0 110.371 170.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 31' ' ' GLN . 7.0 tp-100 -68.71 87.33 0.34 Allowed 'General case' 0 C--N 1.352 0.68 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 172.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.6 m -109.44 112.75 25.04 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -178.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -128.0 113.53 15.95 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 -170.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -106.74 121.98 45.45 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -172.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.5 p -132.01 147.11 32.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.854 0.862 . . . . 0.0 110.832 -171.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.8 m -90.9 111.62 23.13 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.248 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.492 HD21 HD22 ' A' ' 49' ' ' LEU . 29.2 tp -114.62 121.24 42.81 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.254 0.621 . . . . 0.0 109.523 175.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 21.3 m -75.16 149.13 39.09 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.559 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 30.6 ptt180 -69.94 -13.47 62.26 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -174.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -99.42 -19.62 16.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.498 0.719 . . . . 0.0 109.665 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.44 ' HB3' HG21 ' A' ' 51' ' ' THR . 58.0 m -85.54 133.4 42.15 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.197 0.999 . . . . 0.0 109.597 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.467 ' O ' HG22 ' A' ' 51' ' ' THR . 3.3 Cg_exo -71.77 159.42 50.75 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 177.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.492 HD22 HD21 ' A' ' 43' ' ' LEU . 2.7 mm? -53.85 -30.69 46.66 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.06 1.344 . . . . 0.0 111.774 177.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.53 -39.76 58.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.007 0.923 . . . . 0.0 112.935 177.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.467 HG22 ' O ' ' A' ' 48' ' ' PRO . 2.5 t -69.72 -33.12 72.04 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 120.87 0.367 . . . . 0.0 110.888 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.6 tt -70.85 -38.68 73.17 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.254 1.021 . . . . 0.0 110.455 174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.482 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.6 mtt -59.01 -42.77 90.93 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.818 0.847 . . . . 0.0 110.192 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.7 m -61.62 -42.51 98.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.709 1.256 . . . . 0.0 110.827 176.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -68.96 -44.73 72.37 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.316 0.647 . . . . 0.0 110.922 -174.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -58.13 -54.05 51.35 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.304 1.042 . . . . 0.0 111.61 176.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -64.59 -41.62 96.13 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.593 0.558 . . . . 0.0 110.641 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -57.56 -44.37 85.21 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.765 0.426 . . . . 0.0 111.657 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.32 -57.17 7.33 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -103.52 33.06 3.51 Favored 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 117.791 0.269 . . . . 0.0 111.555 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.62 49.7 26.73 Favored Glycine 0 CA--C 1.537 1.447 0 N-CA-C 116.59 1.396 . . . . 0.0 116.59 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -90.88 20.15 5.03 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.024 0.929 . . . . 0.0 111.06 169.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.4 p -68.07 85.1 0.24 Allowed 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 123.628 0.771 . . . . 0.0 110.401 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.61 -41.32 1.24 Allowed Glycine 0 C--N 1.346 1.124 0 C-N-CA 124.043 0.83 . . . . 0.0 111.17 -177.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -100.65 103.26 14.53 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.893 0.877 . . . . 0.0 109.025 175.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -87.55 143.12 27.36 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 120.849 0.357 . . . . 0.0 110.752 -178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.483 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -128.19 153.29 47.06 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.408 1.083 . . . . 0.0 109.951 -175.216 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.1 m -83.22 156.79 22.98 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.85 0.86 . . . . 0.0 111.209 -176.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 36.1 m-85 -125.51 128.95 48.81 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.678 1.191 . . . . 0.0 108.84 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -131.35 139.41 49.51 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.65 0.78 . . . . 0.0 111.033 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -131.59 111.72 11.97 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.429 1.492 . . . . 0.0 108.266 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.5 t70 53.88 30.36 11.39 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.801 1.241 . . . . 0.0 112.044 -175.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 92.07 -19.01 51.96 Favored Glycine 0 CA--C 1.534 1.253 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.712 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.2 m -70.79 137.69 49.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.932 0.893 . . . . 0.0 110.665 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -89.41 117.24 28.19 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.41 109.34 13.68 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 106.857 -1.534 . . . . 0.0 106.857 173.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -79.24 -28.83 42.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.641 0.776 . . . . 0.0 111.457 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 142.65 -52.04 0.66 Allowed Glycine 0 C--N 1.348 1.201 0 C-N-CA 122.994 0.33 . . . . 0.0 113.327 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 41.0 mtp-105 -85.6 2.12 46.35 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.916 0.886 . . . . 0.0 113.315 -168.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.556 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.1 pm0 -85.71 148.82 25.69 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 38.5 mt -100.4 151.35 37.53 Favored Pre-proline 0 C--N 1.316 -0.885 0 C-N-CA 124.957 1.303 . . . . 0.0 108.614 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.559 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 57.5 Cg_endo -65.51 -35.05 40.42 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 121.966 1.777 . . . . 0.0 111.232 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.503 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . . . -60.26 -33.84 72.88 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.971 0.909 . . . . 0.0 111.151 173.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -73.8 -44.67 55.17 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.539 0.735 . . . . 0.0 110.72 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.556 HD21 ' HG3' ' A' ' 80' ' ' GLU . 26.5 mt -66.9 -24.53 66.12 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.217 0.607 . . . . 0.0 110.817 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 88.77 51.79 2.96 Favored Glycine 0 C--N 1.345 1.079 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -175.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.2 mtp -112.82 165.33 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.408 1.083 . . . . 0.0 109.946 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.403 ' HG2' ' N ' ' A' ' 89' ' ' SER . 31.1 tt0 -153.6 166.45 32.72 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.142 0.977 . . . . 0.0 108.839 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.403 ' N ' ' HG2' ' A' ' 88' ' ' GLU . 33.3 m -54.59 111.8 0.88 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.568 0.747 . . . . 0.0 110.052 173.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 132.98 -28.79 3.3 Favored Glycine 0 C--N 1.348 1.206 0 CA-C-O 119.671 -0.516 . . . . 0.0 113.045 -178.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.48 168.21 1.66 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.8 tp -130.26 109.04 10.47 Favored 'General case' 0 C--N 1.349 0.555 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -168.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.7 mt -92.06 152.2 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 171.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -124.06 165.16 17.97 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 -178.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.613 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 14.8 t -137.06 133.61 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 123.805 0.842 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -137.48 131.79 32.36 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.319 1.048 . . . . 0.0 108.745 -170.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.15 0 CA-C-O 118.795 -1.003 . . . . 0.0 112.37 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.6 p . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -99.48 -45.67 5.74 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.425 0.69 . . . . 0.0 109.82 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.1 t -101.05 79.58 2.03 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 122.47 1.128 . . . . 0.0 108.615 175.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.405 ' O ' ' HD3' ' A' ' 45' ' ' ARG . 32.4 m -87.21 130.62 34.49 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 114.205 -1.361 . . . . 0.0 110.341 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -59.95 -48.67 80.74 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.512 0.725 . . . . 0.0 109.24 173.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.577 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 3.2 pp0? -126.46 144.99 50.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.803 173.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -116.06 150.41 37.34 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.03 1.332 . . . . 0.0 107.504 -173.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -99.82 103.32 14.94 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.568 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.8 mm? -101.16 126.97 47.91 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -177.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -91.48 105.28 17.65 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.387 0.675 . . . . 0.0 109.768 -176.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.33 123.82 52.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.041 0.937 . . . . 0.0 108.695 -173.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -130.69 138.19 49.91 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.816 0.446 . . . . 0.0 110.491 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.645 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -75.75 174.12 52.95 Favored Glycine 0 C--N 1.347 1.154 0 O-C-N 123.684 0.615 . . . . 0.0 113.185 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -45.61 -33.28 2.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.132 0.573 . . . . 0.0 111.153 164.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -77.78 110.33 12.56 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.411 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 0.5 OUTLIER -69.67 -25.15 63.76 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -170.205 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.411 ' HD2' ' HG3' ' A' ' 35' ' ' LYS . 19.9 m-70 -85.74 -9.87 56.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.888 0.475 . . . . 0.0 111.314 175.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -77.29 87.71 3.71 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 167.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.4 m -122.66 132.68 54.38 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.167 0.987 . . . . 0.0 109.493 -172.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.5 tp -131.97 154.35 49.4 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 173.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -131.1 132.53 44.91 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 167.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.3 p -131.0 146.39 34.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 C-N-CA 123.613 0.765 . . . . 0.0 109.521 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 28.3 p -90.86 105.94 18.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.568 ' HB3' HD23 ' A' ' 28' ' ' LEU . 66.6 tp -107.34 130.72 54.75 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.919 176.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.577 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 41.9 t -75.62 152.32 37.65 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.654 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 31.6 ptt180 -69.13 -13.38 62.39 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.479 0.712 . . . . 0.0 111.746 179.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -99.13 -23.67 15.16 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.919 0.888 . . . . 0.0 109.882 177.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 64.6 m -82.41 133.04 50.88 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.63 0.772 . . . . 0.0 110.305 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.48 ' O ' HG22 ' A' ' 51' ' ' THR . 6.1 Cg_exo -69.64 158.6 56.54 Favored 'Trans proline' 0 C--N 1.368 1.593 0 C-N-CA 122.833 2.355 . . . . 0.0 113.271 178.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.3 mm? -58.35 -25.79 62.38 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.742 1.217 . . . . 0.0 112.04 177.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.51 -39.16 75.9 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.223 0.609 . . . . 0.0 112.387 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.6 t -72.38 -29.53 63.85 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 120.897 0.38 . . . . 0.0 110.778 -178.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -70.39 -41.45 72.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.037 0.935 . . . . 0.0 110.314 172.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 63.8 mtt -55.02 -49.72 70.85 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.994 0.918 . . . . 0.0 110.835 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 p -67.06 -38.35 85.65 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 124.972 1.42 . . . . 0.0 109.627 -178.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -64.64 -48.79 73.51 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.024 0.53 . . . . 0.0 110.288 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -56.29 -59.08 5.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.088 0.955 . . . . 0.0 111.837 177.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.558 ' HA ' HD23 ' A' ' 62' ' ' LEU . 15.8 pt-20 -62.31 -31.64 72.28 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.027 0.83 . . . . 0.0 112.55 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -70.72 -46.42 63.12 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 122.434 0.294 . . . . 0.0 111.789 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.21 -50.6 45.86 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.55 0.74 . . . . 0.0 112.451 -173.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 59.2 tpp -85.97 25.45 1.13 Allowed 'General case' 0 CA--C 1.572 1.825 0 C-N-CA 124.472 1.109 . . . . 0.0 111.322 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.56 47.88 29.06 Favored Glycine 0 C--N 1.356 1.641 0 N-CA-C 116.633 1.413 . . . . 0.0 116.633 177.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.558 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.9 mm? -83.14 15.53 2.81 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-N 117.416 0.608 . . . . 0.0 112.455 179.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.1 t -62.7 91.35 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.489 0.716 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 156.08 -42.35 0.56 Allowed Glycine 0 C--N 1.347 1.16 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.382 -176.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -124.96 134.22 52.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.87 0.868 . . . . 0.0 109.527 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 52.8 tttp -100.79 134.94 43.01 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 168.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.547 HD11 ' HG ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -123.17 159.82 27.81 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 123.945 0.898 . . . . 0.0 111.038 -164.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.6 m -94.25 160.27 14.76 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.289 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -124.68 131.79 53.44 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.011 0.924 . . . . 0.0 109.37 -177.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -134.06 116.92 16.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.388 1.075 . . . . 0.0 110.534 179.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.428 ' HB3' HD11 ' A' ' 76' ' ' LEU . 2.3 t80 -97.41 109.76 22.45 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.6 t70 51.8 40.57 28.01 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 122.052 0.93 . . . . 0.0 111.02 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 72.71 6.27 66.42 Favored Glycine 0 CA--C 1.538 1.506 0 CA-C-N 114.982 -1.008 . . . . 0.0 114.575 -178.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 90.1 m -87.84 116.99 26.38 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.97 0.908 . . . . 0.0 109.57 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.0 tptp -67.16 113.84 5.43 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.425 0.453 . . . . 0.0 110.232 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.428 HD11 ' HB3' ' A' ' 71' ' ' PHE . 1.1 mm? -80.65 123.69 28.37 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 174.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 4.7 m -75.09 -30.12 60.82 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.768 0.827 . . . . 0.0 110.716 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.91 -38.32 2.27 Favored Glycine 0 C--N 1.345 1.034 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.219 -175.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -87.55 2.56 50.44 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -170.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HG3' HD21 ' A' ' 85' ' ' LEU . 1.7 pm0 -89.54 147.71 23.8 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 172.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.2 mt -97.21 158.08 33.84 Favored Pre-proline 0 C--N 1.312 -1.057 0 C-N-CA 125.119 1.368 . . . . 0.0 108.261 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.654 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 62.0 Cg_endo -66.29 -27.56 47.95 Favored 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 110.781 176.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.69 -37.12 81.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.594 0.757 . . . . 0.0 110.707 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -68.65 -41.33 79.5 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.789 0.835 . . . . 0.0 110.647 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.536 HD21 ' HG3' ' A' ' 80' ' ' GLU . 84.5 mt -75.54 -24.12 56.7 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.074 0.95 . . . . 0.0 112.17 179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.99 58.56 3.18 Favored Glycine 0 C--N 1.346 1.091 0 O-C-N 123.371 0.419 . . . . 0.0 112.22 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 78.8 mtp -102.83 171.0 7.65 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.115 0.966 . . . . 0.0 110.079 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 42.4 tt0 -137.23 157.57 46.35 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.068 0.547 . . . . 0.0 110.876 -178.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 31.3 p -59.28 111.1 1.23 Allowed 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 168.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 94.8 42.23 3.9 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.889 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.536 ' HB3' HD12 ' A' ' 28' ' ' LEU . 2.4 t70 -97.53 -171.57 2.22 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 177.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 35.7 tp -137.03 135.48 37.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.261 0.625 . . . . 0.0 109.5 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 48.4 mt -127.34 148.92 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -123.66 154.36 39.48 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -173.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.645 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.8 t -133.7 121.93 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -125.91 96.77 4.87 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.407 1.083 . . . . 0.0 109.566 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.218 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.352 -179.027 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 20.1 p . . . . . 0 N--CA 1.478 0.944 0 CA-C-O 120.782 0.325 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -100.32 -46.67 5.19 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 168.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -112.56 105.76 14.04 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 105.761 -1.941 . . . . 0.0 105.761 158.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 t -85.5 67.24 10.04 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.549 0.69 . . . . 0.0 111.147 -170.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -83.34 -39.46 20.7 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 152.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.433 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 0.0 OUTLIER -91.44 153.68 19.67 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.563 -177.094 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -116.77 151.01 37.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.698 1.599 . . . . 0.0 109.323 -177.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -103.06 109.78 21.46 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 171.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.513 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.1 mm? -112.24 139.63 47.62 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.3 mtp85 -92.76 112.83 24.93 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.493 0.717 . . . . 0.0 110.546 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.28 113.5 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.499 1.12 . . . . 0.0 108.665 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -126.29 133.59 51.37 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -172.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.578 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -84.07 169.91 46.68 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.718 0.636 . . . . 0.0 112.556 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -55.32 -15.6 2.66 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 173.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -86.96 140.06 29.97 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.248 0.619 . . . . 0.0 109.547 172.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -65.1 -35.2 80.37 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.319 0.648 . . . . 0.0 110.996 175.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -67.48 -36.95 82.12 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.316 0.647 . . . . 0.0 110.511 177.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -74.87 85.87 2.23 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.445 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 57.3 m -123.12 126.79 47.7 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.274 1.03 . . . . 0.0 108.411 172.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -139.85 142.38 36.59 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -133.71 136.61 44.77 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.9 p -140.2 151.71 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 123.919 0.887 . . . . 0.0 109.989 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -92.13 108.67 20.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.424 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.513 ' HB3' HD23 ' A' ' 28' ' ' LEU . 31.2 tp -105.21 131.47 52.64 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.531 1.132 . . . . 0.0 109.178 175.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 44.7 m -76.84 151.65 35.79 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 123.514 0.509 . . . . 0.0 109.654 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.595 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 12.8 ptm180 -67.53 -18.69 65.12 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.257 0.551 . . . . 0.0 110.949 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -92.92 -30.93 15.14 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.138 1.375 . . . . 0.0 109.77 -175.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.414 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 50.6 m -88.34 140.63 30.34 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.21 1.004 . . . . 0.0 110.35 -176.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.506 ' O ' HG22 ' A' ' 51' ' ' THR . 6.8 Cg_exo -67.78 157.66 60.76 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.221 2.614 . . . . 0.0 113.408 179.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -51.79 -32.35 30.88 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.061 1.344 . . . . 0.0 112.068 173.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.466 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -58.88 -35.88 73.72 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.638 0.775 . . . . 0.0 112.593 -177.351 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.506 HG22 ' O ' ' A' ' 48' ' ' PRO . 4.3 t -67.7 -33.69 75.39 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 121.06 0.457 . . . . 0.0 110.435 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.93 -40.78 68.52 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.532 1.133 . . . . 0.0 110.607 175.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.9 mtt -58.83 -46.33 87.92 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.072 0.949 . . . . 0.0 110.865 178.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 p -68.18 -28.06 66.95 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.48 1.112 . . . . 0.0 110.799 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -71.31 -47.7 55.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.323 0.649 . . . . 0.0 110.322 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.26 -58.83 5.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.38 1.072 . . . . 0.0 111.905 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.53 ' HA ' HD23 ' A' ' 62' ' ' LEU . 6.7 pt-20 -59.52 -31.04 69.02 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 124.018 0.823 . . . . 0.0 112.427 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.47 -43.06 70.56 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 172.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.61 -54.68 29.81 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 -174.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.5 mpp? -106.86 34.58 3.37 Favored 'General case' 0 N--CA 1.501 2.089 0 C-N-CA 122.392 0.277 . . . . 0.0 111.494 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 46.09 48.41 14.74 Favored Glycine 0 N--CA 1.474 1.184 0 N-CA-C 116.92 1.528 . . . . 0.0 116.92 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.53 HD23 ' HA ' ' A' ' 57' ' ' GLU . 2.5 mm? -81.74 21.6 0.82 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.37 0.668 . . . . 0.0 112.407 177.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.9 p -70.28 123.75 22.46 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.301 0.64 . . . . 0.0 110.766 176.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 130.38 -77.96 0.39 Allowed Glycine 0 C--N 1.35 1.322 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -178.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -87.46 116.05 25.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 171.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -80.25 150.14 30.14 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.466 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -127.67 149.98 49.96 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.296 1.038 . . . . 0.0 109.7 -177.409 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.5 m -93.3 158.69 15.61 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.424 0.69 . . . . 0.0 110.732 -175.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 94' ' ' GLU . 48.1 m-85 -124.32 127.83 48.21 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.432 1.093 . . . . 0.0 109.375 -176.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -126.25 129.76 49.57 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.082 0.953 . . . . 0.0 110.195 -178.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.494 ' HB3' HD21 ' A' ' 76' ' ' LEU . 51.6 t80 -108.02 109.41 20.86 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.77 27.08 16.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.557 1.143 . . . . 0.0 111.391 -172.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 84.55 -2.11 88.26 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.055 -0.521 . . . . 0.0 113.852 -175.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 16.8 m -79.01 122.56 26.34 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -67.87 117.64 10.02 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 71' ' ' PHE . 21.5 mt -92.29 120.34 32.74 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 41.2 t -77.47 -23.02 50.49 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.264 0.626 . . . . 0.0 110.965 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.99 -38.64 2.99 Favored Glycine 0 C--N 1.344 0.991 0 C-N-CA 123.043 0.354 . . . . 0.0 113.286 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.7 mtp180 -76.41 -14.98 60.04 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.558 0.743 . . . . 0.0 112.849 -171.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -72.24 149.02 44.94 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 173.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 48' ' ' PRO . 21.8 mt -99.13 157.21 34.46 Favored Pre-proline 0 C--N 1.304 -1.402 0 C-N-CA 125.161 1.384 . . . . 0.0 107.302 176.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.595 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.1 Cg_endo -65.54 -17.02 56.3 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 121.466 1.444 . . . . 0.0 111.39 178.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.78 93.38 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.747 0.819 . . . . 0.0 111.006 170.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -68.01 -45.62 73.54 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.107 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.514 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 79.5 mt -74.24 -15.0 61.01 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.616 0.766 . . . . 0.0 112.561 -176.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.67 35.73 27.86 Favored Glycine 0 C--N 1.347 1.173 0 O-C-N 123.153 0.283 . . . . 0.0 112.991 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.514 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 60.5 mtp -90.22 166.4 13.38 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.169 0.988 . . . . 0.0 110.855 -177.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -153.81 166.38 33.07 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 178.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.3 t -61.51 112.05 2.05 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.888 0.475 . . . . 0.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 130.5 -27.63 3.92 Favored Glycine 0 C--N 1.35 1.343 0 CA-C-O 119.608 -0.551 . . . . 0.0 112.814 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.451 ' HB2' HD12 ' A' ' 28' ' ' LEU . 1.8 m-20 -58.08 172.72 0.4 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 49.2 tp -133.83 113.94 12.8 Favored 'General case' 0 C--N 1.352 0.682 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.393 -163.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.411 HD11 ' HE1' ' A' ' 87' ' ' MET . 39.4 mt -100.39 149.17 6.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 172.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 69' ' ' PHE . 36.5 mt-10 -112.96 158.38 20.31 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -172.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.578 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.1 t -135.15 118.73 24.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 -178.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -111.31 106.17 15.04 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.277 1.431 . . . . 0.0 109.033 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.447 0 CA-C-O 118.55 -1.139 . . . . 0.0 111.572 179.263 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 CA--C 1.55 0.973 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -141.16 -49.25 0.41 Allowed 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 118.458 0.572 . . . . 0.0 111.312 172.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.4 p -113.36 81.23 1.47 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.329 0.652 . . . . 0.0 112.446 -177.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 p -100.96 66.18 1.14 Allowed 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 122.504 1.145 . . . . 0.0 108.792 166.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.659 ' HG3' ' HG2' ' A' ' 25' ' ' GLN . 7.6 pt20 -84.55 -49.48 8.56 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 113.799 -1.546 . . . . 0.0 109.986 164.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.659 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 4.8 mm-40 -103.53 156.68 17.59 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.224 1.01 . . . . 0.0 110.692 -171.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 82.8 mt -91.55 129.67 37.5 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.587 -174.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -89.17 102.73 15.38 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.636 HD23 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mm? -106.19 122.02 45.35 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 -89.79 124.36 34.59 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.328 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -102.83 117.17 47.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 C-N-CA 124.223 1.009 . . . . 0.0 109.54 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -127.01 130.92 50.96 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.965 0.906 . . . . 0.0 108.579 -178.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.485 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -93.11 170.31 31.56 Favored Glycine 0 C--N 1.339 0.698 0 O-C-N 123.753 0.658 . . . . 0.0 113.596 -173.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.0 ptmm? -58.15 -12.48 3.56 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.91 0.884 . . . . 0.0 112.007 163.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -77.19 107.66 9.73 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 105.478 -2.045 . . . . 0.0 105.478 164.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -63.99 -19.92 65.51 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -165.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 62.0 m170 -99.76 -8.1 24.67 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.929 0.492 . . . . 0.0 111.714 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -69.6 88.85 0.52 Allowed 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.158 0.583 . . . . 0.0 110.345 178.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 m -106.41 107.84 19.05 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 171.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -131.2 137.47 48.97 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -132.01 141.57 49.3 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.056 0.455 . . . . 0.0 109.878 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.33 152.6 21.58 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 C-N-CA 124.119 0.968 . . . . 0.0 109.84 178.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -91.71 110.78 22.12 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.636 ' HB3' HD23 ' A' ' 28' ' ' LEU . 32.2 tp -102.85 136.66 42.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.465 0.706 . . . . 0.0 109.824 176.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 34.0 t -76.29 143.88 40.62 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.582 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 13.1 ptm180 -60.58 -29.41 69.17 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.986 0.914 . . . . 0.0 112.835 -175.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -110.57 3.06 19.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.532 0.733 . . . . 0.0 111.977 -178.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 70.1 m -93.47 134.04 27.33 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 170.385 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.567 ' O ' HG22 ' A' ' 51' ' ' THR . 2.8 Cg_exo -65.95 155.69 68.21 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.753 2.302 . . . . 0.0 112.784 -176.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' MET . 3.9 mm? -53.54 -27.53 26.54 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.982 1.313 . . . . 0.0 112.322 176.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.501 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.69 -37.98 74.39 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.759 0.824 . . . . 0.0 112.949 179.555 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 48' ' ' PRO . 7.3 t -67.3 -33.31 75.02 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-O 121.348 0.594 . . . . 0.0 110.359 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.36 -41.06 66.82 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.961 1.304 . . . . 0.0 110.442 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.2 mtt -55.05 -44.03 74.34 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.93 0.892 . . . . 0.0 110.915 176.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -67.26 -35.38 79.39 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -71.53 -46.76 58.7 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.909 0.484 . . . . 0.0 110.777 -175.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -54.09 -57.46 11.0 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.811 0.845 . . . . 0.0 111.743 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.49 ' HA ' HD23 ' A' ' 62' ' ' LEU . 7.7 pt-20 -60.1 -31.83 70.41 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 123.894 0.746 . . . . 0.0 111.768 -177.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.51 -36.75 76.75 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 173.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.87 -52.87 59.08 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.3 mpp? -106.39 27.24 8.93 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 122.446 0.298 . . . . 0.0 110.941 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 40.12 53.65 3.25 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 116.46 1.344 . . . . 0.0 116.46 -179.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 57' ' ' GLU . 3.6 mm? -68.45 70.9 0.18 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.679 1.192 . . . . 0.0 112.367 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 50.3 m -101.47 116.36 32.59 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.09 0.956 . . . . 0.0 108.771 172.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 115.28 -78.58 0.27 Allowed Glycine 0 C--N 1.346 1.111 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -70.45 104.92 2.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 171.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -101.11 148.34 25.18 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.517 HD23 ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -126.75 157.66 38.56 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.659 0.784 . . . . 0.0 111.728 -166.328 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 31.8 m -113.32 156.57 23.14 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.306 1.042 . . . . 0.0 109.803 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.517 ' CE1' HD23 ' A' ' 67' ' ' LEU . 38.9 m-85 -122.61 128.2 50.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.659 0.784 . . . . 0.0 110.041 -172.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 60.7 m-85 -127.44 139.32 52.9 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.868 0.867 . . . . 0.0 110.783 -178.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -116.24 107.08 14.41 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 173.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 51.19 41.42 27.73 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 122.093 0.949 . . . . 0.0 111.244 -172.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 83.55 -8.22 66.02 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 115.032 -0.985 . . . . 0.0 114.949 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 88.8 m -74.51 115.58 14.21 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.225 0.61 . . . . 0.0 109.719 178.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.48 114.06 4.59 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 176.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.01 109.12 16.06 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.6 m -69.48 -28.11 65.79 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.089 0.955 . . . . 0.0 111.005 -176.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 134.52 -49.5 0.9 Allowed Glycine 0 C--N 1.35 1.326 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.385 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 -87.42 10.83 16.22 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.628 0.771 . . . . 0.0 112.967 -170.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.9 mp0 -83.87 148.13 27.14 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 173.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 30.3 mt -101.26 152.05 37.86 Favored Pre-proline 0 C--N 1.309 -1.182 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 176.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.582 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 59.1 Cg_endo -64.36 -35.66 49.14 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.687 1.591 . . . . 0.0 110.989 178.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.52 -30.55 70.25 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.164 0.586 . . . . 0.0 110.8 175.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -71.87 -45.16 62.31 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.805 0.842 . . . . 0.0 111.592 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.425 ' HB2' ' HG3' ' A' ' 87' ' ' MET . 54.6 mt -69.91 -24.94 63.46 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.49 0.716 . . . . 0.0 111.487 -176.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.0 45.92 3.48 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 111.44 -0.664 . . . . 0.0 111.44 -173.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.425 ' HG3' ' HB2' ' A' ' 85' ' ' LEU . 63.3 mtp -104.76 163.97 12.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.158 0.983 . . . . 0.0 108.99 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.415 ' HG2' ' H ' ' A' ' 89' ' ' SER . 38.4 tt0 -135.07 178.37 7.08 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 -176.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.415 ' H ' ' HG2' ' A' ' 88' ' ' GLU . 30.0 p -74.19 19.22 0.13 Allowed 'General case' 0 CA--C 1.561 1.378 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -176.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -160.09 61.14 0.3 Allowed Glycine 0 C--N 1.344 0.985 0 N-CA-C 111.443 -0.663 . . . . 0.0 111.443 172.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.485 ' HB2' HD12 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -111.12 -177.49 3.22 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.568 0.747 . . . . 0.0 109.399 177.758 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 37.6 tp -137.52 114.78 10.94 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 109.913 -167.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 43.1 mt -98.11 150.91 4.58 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 113.956 -1.474 . . . . 0.0 108.563 173.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 70' ' ' PHE . 41.9 mt-10 -106.14 152.86 22.89 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 -175.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.485 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 53.6 t -130.63 109.44 16.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -115.93 96.36 5.55 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.156 0.982 . . . . 0.0 109.835 -174.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.256 0 CA-C-O 118.855 -0.97 . . . . 0.0 111.708 177.259 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.1 m . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -77.68 -176.0 4.14 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.226 1.01 . . . . 0.0 111.746 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.6 p -60.99 101.79 0.17 Allowed 'General case' 0 C--N 1.354 0.771 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 165.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -74.52 99.49 3.61 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.975 -170.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.483 ' HG2' ' HG3' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -67.67 -27.95 67.28 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.275 0.63 . . . . 0.0 110.145 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 40.4 mt-30 -126.74 143.01 51.37 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 170.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.42 HD12 ' HB2' ' A' ' 82' ' ' PRO . 56.2 mt -107.84 129.27 55.08 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.187 1.395 . . . . 0.0 109.173 -177.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -84.25 103.12 13.18 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 22.2 mt -112.27 132.49 54.92 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.034 0.534 . . . . 0.0 110.336 -175.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -91.2 110.59 21.88 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.169 0.987 . . . . 0.0 109.021 -178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.443 HG11 ' HE2' ' A' ' 69' ' ' PHE . 2.2 t -105.78 124.72 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -177.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -135.5 145.14 46.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 118.099 0.409 . . . . 0.0 110.359 -173.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.626 ' HA3' HE21 ' A' ' 37' ' ' GLN . . . -83.54 176.01 52.41 Favored Glycine 0 C--N 1.348 1.225 0 O-C-N 123.374 0.421 . . . . 0.0 112.538 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -42.54 -27.33 0.16 Allowed 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.332 1.053 . . . . 0.0 113.428 166.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -104.22 123.59 47.6 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 165.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -71.75 -11.04 60.63 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.178 0.591 . . . . 0.0 111.624 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -62.53 -40.99 98.53 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.299 0.64 . . . . 0.0 109.552 169.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.626 HE21 ' HA3' ' A' ' 32' ' ' GLY . 25.9 tt0 -75.18 90.41 2.55 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.275 172.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 m -121.76 140.66 52.06 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.901 0.88 . . . . 0.0 110.192 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' A' ' 56' ' ' TYR . 15.2 tp -138.3 127.39 24.16 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 167.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -103.17 113.03 26.18 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 175.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.95 151.17 23.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 123.828 0.851 . . . . 0.0 110.435 -172.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -92.49 109.23 20.62 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 171.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.433 ' HB2' HD12 ' A' ' 52' ' ' LEU . 23.6 tp -105.82 125.53 51.1 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.25 0.62 . . . . 0.0 109.381 172.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 58.6 m -73.18 144.34 46.87 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.525 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 26.4 ptt180 -62.54 -26.51 68.61 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.876 0.87 . . . . 0.0 112.398 -173.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -99.56 -11.7 20.78 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.783 0.833 . . . . 0.0 111.029 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 50.4 m -92.34 136.77 25.19 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 123.743 0.817 . . . . 0.0 109.381 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.551 ' O ' HG22 ' A' ' 51' ' ' THR . 3.7 Cg_exo -71.41 161.69 44.75 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 122.796 2.331 . . . . 0.0 113.781 -176.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.558 HD11 ' HE1' ' A' ' 87' ' ' MET . 3.8 mm? -53.83 -31.4 49.14 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 125.241 1.416 . . . . 0.0 112.242 175.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -32.71 72.42 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.551 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -70.18 -33.26 71.51 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-N 118.113 0.415 . . . . 0.0 111.036 174.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.433 HD12 ' HB2' ' A' ' 43' ' ' LEU . 6.3 tt -68.94 -39.31 79.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.1 0.96 . . . . 0.0 110.126 173.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.3 mtt -59.01 -42.73 90.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.327 1.051 . . . . 0.0 110.09 175.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 30.7 t -68.02 -40.28 82.97 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.259 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -66.63 -48.2 70.2 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 120.952 0.406 . . . . 0.0 110.569 -174.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.417 ' HA ' HD22 ' A' ' 39' ' ' LEU . 50.4 t80 -55.18 -53.46 55.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.005 1.322 . . . . 0.0 112.213 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.83 -46.62 84.26 Favored 'General case' 0 CA--C 1.558 1.253 0 O-C-N 124.154 0.908 . . . . 0.0 110.908 -179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.38 -45.54 84.36 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.241 0.616 . . . . 0.0 111.994 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -57.42 -46.77 83.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 124.074 0.95 . . . . 0.0 112.935 -178.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.2 mtm -102.34 33.54 3.09 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.084 0.554 . . . . 0.0 111.827 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 48.36 35.37 14.95 Favored Glycine 0 CA--C 1.537 1.425 0 N-CA-C 117.492 1.757 . . . . 0.0 117.492 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -94.3 42.01 1.09 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.02 0.928 . . . . 0.0 108.75 167.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.9 m -67.67 112.33 4.72 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.066 0.946 . . . . 0.0 111.458 -175.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.87 19.28 65.79 Favored Glycine 0 C--N 1.344 1.021 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.204 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -139.91 78.01 1.64 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.826 1.25 . . . . 0.0 107.794 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.419 ' HD2' ' HB3' ' A' ' 53' ' ' MET . 7.2 ttpm? -80.07 135.63 36.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.654 0.74 . . . . 0.0 110.54 -176.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -98.19 160.29 14.39 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.38 1.472 . . . . 0.0 108.213 177.261 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.593 ' HB2' ' HB2' ' A' ' 96' ' ' TRP . 21.1 m -76.95 144.46 38.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.407 0.283 . . . . 0.0 110.892 -174.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.451 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 49.2 m-85 -120.26 125.85 49.13 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.894 0.877 . . . . 0.0 109.892 179.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -125.13 133.08 52.97 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.266 1.026 . . . . 0.0 110.094 177.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.447 ' HB3' HD21 ' A' ' 76' ' ' LEU . 83.1 t80 -124.46 114.56 19.63 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.219 1.008 . . . . 0.0 108.538 174.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.14 27.83 15.58 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.593 1.157 . . . . 0.0 111.368 -176.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 86.84 -8.17 76.98 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.314 -0.857 . . . . 0.0 113.828 -177.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 96.7 m -73.76 119.86 18.56 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.114 0.566 . . . . 0.0 110.272 176.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -68.07 113.5 5.79 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.447 HD21 ' HB3' ' A' ' 71' ' ' PHE . 25.3 mt -82.03 116.84 21.82 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 19.7 m -73.37 -31.65 64.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.656 0.782 . . . . 0.0 111.155 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 131.8 -48.65 0.96 Allowed Glycine 0 C--N 1.343 0.923 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.296 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 51.5 mtp85 -86.45 9.72 17.34 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -169.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -84.66 147.54 26.89 Favored 'General case' 0 C--N 1.343 0.325 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 166.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.3 mt -95.16 161.96 26.41 Favored Pre-proline 0 C--N 1.313 -0.981 0 C-N-CA 124.541 1.136 . . . . 0.0 108.566 174.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.525 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 60.8 Cg_endo -66.23 -30.29 46.07 Favored 'Trans proline' 0 C--N 1.368 1.581 0 C-N-CA 121.429 1.419 . . . . 0.0 110.812 174.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.4 80.12 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 124.053 0.941 . . . . 0.0 111.032 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -69.54 -48.78 59.25 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.016 0.927 . . . . 0.0 111.841 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.426 HD12 ' HE2' ' A' ' 87' ' ' MET . 87.9 mt -71.83 -20.8 61.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.433 0.693 . . . . 0.0 111.397 -177.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.92 15.66 51.29 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 123.455 0.472 . . . . 0.0 112.456 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.558 ' HE1' HD11 ' A' ' 49' ' ' LEU . 57.9 mtm -76.54 160.09 29.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.326 0.65 . . . . 0.0 110.869 177.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -160.82 166.64 28.24 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.712 1.205 . . . . 0.0 107.981 -170.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 33.1 m -61.04 106.08 0.55 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 118.029 0.377 . . . . 0.0 110.519 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 136.56 -32.73 2.43 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.032 -0.531 . . . . 0.0 113.219 -176.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.7 170.81 0.07 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.4 tp -132.16 109.28 9.85 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -168.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 51.6 mt -95.94 147.96 5.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 107.567 -1.272 . . . . 0.0 107.567 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -124.06 161.76 24.89 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -172.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.557 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 12.7 t -140.06 128.04 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.844 0.858 . . . . 0.0 110.418 -169.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.593 ' HB2' ' HB2' ' A' ' 68' ' ' SER . 55.9 m95 -106.11 97.88 7.64 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 171.028 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -175.349 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.04 -45.18 61.79 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 172.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -138.67 120.84 15.76 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.788 176.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -84.57 101.08 11.83 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -70.21 -29.75 66.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 121.592 0.711 . . . . 0.0 109.334 174.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? -139.15 139.88 37.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.524 1.13 . . . . 0.0 108.69 166.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.5 mp -110.23 147.95 32.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.23 1.412 . . . . 0.0 108.431 -172.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -102.14 104.73 15.35 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.547 HD23 ' HB3' ' A' ' 43' ' ' LEU . 1.9 mm? -104.65 135.85 45.28 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -175.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -90.59 128.94 36.75 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 175.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.94 123.21 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -172.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -134.01 141.06 47.09 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.016 0.371 . . . . 0.0 110.564 -173.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.666 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -76.47 175.37 53.1 Favored Glycine 0 C--N 1.342 0.894 0 O-C-N 123.871 0.732 . . . . 0.0 112.323 177.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -39.52 -37.35 0.47 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.719 0.807 . . . . 0.0 110.815 161.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.6 mp0 -84.29 113.98 21.52 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 171.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.66 -32.64 74.4 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.066 0.547 . . . . 0.0 112.349 -177.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -69.99 -22.66 63.11 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.391 0.677 . . . . 0.0 110.885 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -78.18 89.32 4.26 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.971 0.908 . . . . 0.0 108.647 174.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.0 m -125.98 137.0 53.65 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.603 0.761 . . . . 0.0 111.267 -172.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.3 tp -136.3 136.29 39.63 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -119.54 122.85 42.55 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.0 p -128.76 149.45 33.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 123.935 0.894 . . . . 0.0 110.562 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.9 p -92.93 108.94 20.39 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 178.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 28' ' ' LEU . 28.1 tp -103.91 134.33 47.38 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.456 1.102 . . . . 0.0 109.494 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.9 t -79.0 145.72 33.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.627 ' HB2' ' HB2' ' A' ' 83' ' ' ALA . 33.6 ptt180 -68.41 -13.51 62.35 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.753 0.421 . . . . 0.0 112.041 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -97.65 -21.71 16.88 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.115 0.966 . . . . 0.0 109.91 177.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.6 m -88.38 134.75 33.85 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.509 ' O ' HG22 ' A' ' 51' ' ' THR . 5.4 Cg_exo -71.11 163.39 39.36 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 122.71 2.273 . . . . 0.0 112.968 178.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 53' ' ' MET . 2.6 mm? -60.65 -22.94 64.38 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.479 1.112 . . . . 0.0 111.655 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.43 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -56.94 -38.29 72.72 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.302 0.641 . . . . 0.0 112.166 178.52 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 48' ' ' PRO . 5.6 t -71.0 -28.77 64.66 Favored 'General case' 0 C--N 1.355 0.84 0 CA-C-O 120.862 0.363 . . . . 0.0 110.723 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -74.58 -41.11 61.08 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 110.359 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 64.2 mtt -55.43 -48.93 73.68 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.785 0.834 . . . . 0.0 111.051 175.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.7 p -70.41 -33.63 71.58 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 113.868 -1.515 . . . . 0.0 109.61 -176.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.11 -52.7 46.25 Favored 'General case' 0 C--N 1.354 0.787 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -55.84 -60.7 3.09 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 123.829 0.852 . . . . 0.0 111.506 -177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.43 -38.11 79.81 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 123.792 0.682 . . . . 0.0 112.749 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -74.66 -29.07 61.11 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 177.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.35 -50.33 9.03 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.087 0.555 . . . . 0.0 111.804 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 59.6 tpp -72.8 -22.91 60.74 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.428 1.091 . . . . 0.0 111.419 -172.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.04 35.39 4.25 Favored Glycine 0 C--N 1.354 1.583 0 O-C-N 122.128 -0.358 . . . . 0.0 113.23 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.16 123.65 40.99 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.055 0.942 . . . . 0.0 110.337 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.5 t -156.9 169.13 25.49 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 124.788 1.235 . . . . 0.0 108.971 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.82 -66.63 3.81 Favored Glycine 0 C--N 1.349 1.251 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -173.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.5 ptt85 -96.01 130.55 42.99 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.22 1.008 . . . . 0.0 109.331 170.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -99.75 144.18 29.12 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 172.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.471 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -116.55 155.16 29.16 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.029 0.932 . . . . 0.0 110.998 -167.866 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 71.1 m -91.58 163.51 14.1 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.99 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 53' ' ' MET . 35.4 m-85 -129.02 130.45 46.62 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.319 1.048 . . . . 0.0 108.968 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -130.44 129.02 42.46 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.726 0.81 . . . . 0.0 111.485 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -119.2 111.99 18.93 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.632 1.573 . . . . 0.0 107.673 172.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 51.56 40.69 27.61 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.065 0.936 . . . . 0.0 112.011 -177.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 81.54 -19.28 9.14 Favored Glycine 0 N--CA 1.478 1.457 0 CA-C-N 115.012 -0.994 . . . . 0.0 114.589 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 82.7 m -71.23 116.03 11.07 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.458 0.703 . . . . 0.0 109.919 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -70.87 113.69 8.18 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.33 175.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.22 116.23 13.51 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.3 m -74.06 -35.68 64.29 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.153 0.981 . . . . 0.0 111.886 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.15 -56.25 0.51 Allowed Glycine 0 C--N 1.347 1.165 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.925 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -89.77 10.29 24.06 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -167.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.512 ' HG3' HD21 ' A' ' 85' ' ' LEU . 0.9 OUTLIER -86.43 148.46 25.55 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 175.415 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.1 mt -101.39 149.84 36.69 Favored Pre-proline 0 C--N 1.315 -0.92 0 C-N-CA 124.993 1.317 . . . . 0.0 109.18 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.586 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 56.7 Cg_endo -66.13 -24.79 51.4 Favored 'Trans proline' 0 C--N 1.377 2.073 0 C-N-CA 122.07 1.846 . . . . 0.0 111.44 179.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.627 ' HB2' ' HB2' ' A' ' 45' ' ' ARG . . . -60.64 -47.45 86.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.813 0.845 . . . . 0.0 110.267 170.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -71.17 -32.68 69.2 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.638 -1.164 . . . . 0.0 111.808 -175.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.512 HD21 ' HG3' ' A' ' 80' ' ' GLU . 72.9 mt -75.63 -23.04 56.3 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.551 0.74 . . . . 0.0 111.175 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 79.41 52.62 4.72 Favored Glycine 0 C--N 1.344 1.026 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 -175.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 71.5 mtp -97.58 174.87 6.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.678 0.791 . . . . 0.0 110.148 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.5 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 38.6 tt0 -133.99 155.8 49.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.241 0.616 . . . . 0.0 110.576 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 45.2 p -63.05 115.19 4.21 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 165.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 85.54 52.63 3.3 Favored Glycine 0 C--N 1.342 0.879 0 N-CA-C 111.613 -0.595 . . . . 0.0 111.613 -169.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 1.4 t70 -110.07 -159.46 0.68 Allowed 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 178.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.4 tp -142.93 143.54 32.04 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.865 0.841 . . . . 0.0 110.576 -175.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 60.2 mt -139.3 150.78 22.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 C-N-CA 126.472 1.909 . . . . 0.0 106.734 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -121.68 168.04 12.24 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 109.625 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.666 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 44.0 t -142.41 105.3 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 -174.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -114.75 94.9 4.97 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.736 0.779 . . . . 0.0 109.636 -175.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.581 0 CA-C-N 114.119 -1.4 . . . . 0.0 110.306 -179.169 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 18.4 m . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.77 -41.59 6.82 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 174.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -111.26 120.36 41.99 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 163.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -66.41 86.86 0.11 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.403 0.681 . . . . 0.0 112.368 -174.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -77.41 -48.54 16.95 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 170.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -131.02 154.56 48.07 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 124.437 1.095 . . . . 0.0 108.569 174.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 82' ' ' PRO . 77.2 mt -108.21 125.98 52.27 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.886 1.274 . . . . 0.0 109.53 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.53 102.92 14.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 42.4 mt -110.39 131.44 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.08 0.552 . . . . 0.0 109.75 -173.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 92' ' ' LEU . 64.4 mtt85 -94.3 109.94 21.72 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.518 0.727 . . . . 0.0 109.213 -178.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -101.13 127.63 54.16 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.451 ' HG2' HG23 ' A' ' 38' ' ' THR . 70.8 mt-30 -134.45 153.1 52.1 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -177.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.599 ' HA3' HE21 ' A' ' 37' ' ' GLN . . . -90.97 -177.77 43.58 Favored Glycine 0 N--CA 1.463 0.435 0 O-C-N 123.399 0.437 . . . . 0.0 112.766 175.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -48.43 -16.45 0.11 Allowed 'General case' 0 CA--C 1.562 1.435 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 164.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.08 135.39 55.2 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.623 1.169 . . . . 0.0 109.225 172.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.93 -14.02 61.37 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.354 0.662 . . . . 0.0 112.127 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -64.15 -35.03 79.44 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 173.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.599 HE21 ' HA3' ' A' ' 32' ' ' GLY . 28.4 tt0 -90.07 87.04 6.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.679 173.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.451 HG23 ' HG2' ' A' ' 31' ' ' GLN . 90.7 m -129.33 141.5 51.07 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.715 0.806 . . . . 0.0 109.829 175.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 tp -142.59 144.66 32.96 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 124.585 1.154 . . . . 0.0 108.158 174.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -120.22 115.68 24.09 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 106.403 -1.703 . . . . 0.0 106.403 173.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -123.42 150.05 27.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 123.936 0.894 . . . . 0.0 110.134 -170.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.7 m -92.21 108.57 20.05 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 176.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.7 tp -105.54 123.59 48.15 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.2 m -72.87 147.71 45.11 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -177.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -61.34 -27.69 68.68 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.955 0.902 . . . . 0.0 112.482 -171.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -101.07 -12.05 19.15 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.549 0.739 . . . . 0.0 111.006 -178.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 67.7 m -83.82 134.8 43.66 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 123.293 0.637 . . . . 0.0 109.819 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.586 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 2.7 Cg_exo -67.78 158.01 59.19 Favored 'Trans proline' 0 C--N 1.368 1.554 0 C-N-CA 122.707 2.271 . . . . 0.0 113.122 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.65 HD11 ' HE1' ' A' ' 87' ' ' MET . 4.0 mm? -54.24 -30.78 51.43 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 124.782 1.233 . . . . 0.0 111.974 175.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.586 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.1 OUTLIER -57.57 -34.37 69.13 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.487 HG22 ' O ' ' A' ' 48' ' ' PRO . 2.8 t -71.77 -33.01 68.27 Favored 'General case' 0 CA--C 1.553 1.074 0 CA-C-O 120.862 0.363 . . . . 0.0 110.936 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.3 tt -68.43 -41.76 79.89 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.539 1.135 . . . . 0.0 110.356 173.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.464 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 65.1 mtt -58.5 -48.31 81.22 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.189 0.995 . . . . 0.0 109.74 176.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.7 t -63.1 -38.73 92.36 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 113.998 -1.455 . . . . 0.0 110.901 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -63.02 -50.1 72.03 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.004 0.522 . . . . 0.0 110.06 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.495 ' CE2' HG21 ' A' ' 95' ' ' VAL . 48.2 t80 -55.82 -57.03 13.74 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.558 1.143 . . . . 0.0 112.389 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -65.77 -42.5 90.77 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.374 -176.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -63.8 -38.22 90.28 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -55.85 -52.59 63.5 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.753 0.821 . . . . 0.0 113.098 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.5 mtm -102.17 35.73 2.32 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 122.939 0.496 . . . . 0.0 111.683 -175.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 49.27 37.52 24.59 Favored Glycine 0 C--N 1.348 1.196 0 N-CA-C 117.586 1.794 . . . . 0.0 117.586 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -90.84 36.0 0.9 Allowed 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 117.68 0.74 . . . . 0.0 109.923 167.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 m -65.19 104.82 0.97 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.799 0.84 . . . . 0.0 110.109 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 102.8 -36.97 3.94 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 111.481 -0.648 . . . . 0.0 111.481 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -88.55 78.48 7.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.694 0.798 . . . . 0.0 109.18 177.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -79.59 144.64 33.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.589 0.356 . . . . 0.0 110.37 -176.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.459 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -120.91 157.19 30.4 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.89 1.276 . . . . 0.0 108.95 -178.917 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.421 ' O ' ' HA ' ' A' ' 95' ' ' VAL . 17.4 m -77.23 153.06 34.4 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.859 0.463 . . . . 0.0 111.089 -176.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -125.61 125.61 43.41 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.084 0.954 . . . . 0.0 109.317 178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -124.86 143.67 50.71 Favored 'General case' 0 C--O 1.212 -0.881 0 C-N-CA 124.001 0.92 . . . . 0.0 109.973 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -118.91 105.48 11.53 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 174.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.6 t70 55.76 28.33 12.11 Favored 'General case' 0 CA--C 1.562 1.427 0 C-N-CA 124.145 0.978 . . . . 0.0 111.691 -170.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.04 1.5 79.38 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 113.692 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.3 m -79.1 119.62 22.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.474 0.71 . . . . 0.0 109.413 174.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.65 114.01 8.31 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.6 mt -83.4 126.69 33.0 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.0 m -83.38 -34.44 25.57 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.507 0.723 . . . . 0.0 111.845 -175.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.99 -60.87 0.56 Allowed Glycine 0 C--N 1.337 0.601 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.57 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 57.3 mtp85 -84.02 5.96 23.84 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -169.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HG3' HD21 ' A' ' 85' ' ' LEU . 2.6 pm0 -76.31 147.86 37.9 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 170.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -100.1 162.7 20.15 Favored Pre-proline 0 C--N 1.31 -1.139 0 C-N-CA 124.424 1.09 . . . . 0.0 108.883 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.494 ' HB2' HD12 ' A' ' 26' ' ' LEU . 62.9 Cg_endo -66.8 -23.51 48.05 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 121.606 1.537 . . . . 0.0 111.01 174.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.97 -32.95 73.72 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.919 0.887 . . . . 0.0 111.244 171.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.61 -47.63 21.73 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.723 0.809 . . . . 0.0 110.922 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.492 HD21 ' HG3' ' A' ' 80' ' ' GLU . 77.3 mt -72.13 -15.29 61.98 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.32 0.648 . . . . 0.0 111.404 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.36 28.36 55.82 Favored Glycine 0 C--N 1.349 1.304 0 O-C-N 123.529 0.518 . . . . 0.0 112.534 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.65 ' HE1' HD11 ' A' ' 49' ' ' LEU . 66.2 mtm -84.36 168.21 15.8 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.72 0.808 . . . . 0.0 111.593 177.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -155.87 169.3 24.73 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.715 1.206 . . . . 0.0 108.367 -177.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 41.7 m -57.39 112.25 1.35 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.26 0.624 . . . . 0.0 110.911 179.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 122.71 -14.21 8.6 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-O 119.624 -0.542 . . . . 0.0 113.629 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.49 170.46 1.02 Allowed 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 175.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 29' ' ' ARG . 43.9 tp -132.61 111.7 11.43 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.877 -169.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 56.8 mt -100.63 152.31 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.525 1.13 . . . . 0.0 108.182 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -115.45 163.33 15.88 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.687 1.195 . . . . 0.0 108.741 -171.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.534 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 22.3 t -136.97 110.1 8.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 124.465 1.106 . . . . 0.0 108.994 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.8 m95 -108.77 93.62 4.62 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.943 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 -177.002 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 121.027 0.441 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -100.1 -44.52 5.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.05 0.94 . . . . 0.0 110.044 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 65.9 p -101.74 121.29 41.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.1 m -73.68 70.3 1.35 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 122.208 1.004 . . . . 0.0 112.363 -176.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -80.75 -38.27 28.96 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.026 1.33 . . . . 0.0 108.328 169.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.58 ' HA ' ' HA ' ' A' ' 44' ' ' SER . 10.4 pt20 -113.88 151.28 32.41 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 114.3 -1.318 . . . . 0.0 109.019 171.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.424 HD12 ' HB2' ' A' ' 82' ' ' PRO . 53.5 mt -114.29 128.91 56.58 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.47 1.508 . . . . 0.0 109.448 177.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.23 105.17 17.28 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.05 135.66 52.41 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.822 0.849 . . . . 0.0 109.831 -169.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.613 ' HG2' ' HB3' ' A' ' 40' ' ' GLU . 81.6 mtt180 -95.38 111.99 23.78 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.823 0.849 . . . . 0.0 110.313 -177.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.17 129.97 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.987 0.915 . . . . 0.0 109.874 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -131.05 146.67 52.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.76 0.824 . . . . 0.0 108.923 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.63 ' HA2' ' HB ' ' A' ' 95' ' ' VAL . . . -86.49 -177.02 49.61 Favored Glycine 0 N--CA 1.466 0.693 0 C-N-CA 121.603 -0.332 . . . . 0.0 113.138 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 33' ' ' LYS . 48.6 mtpt -29.66 -46.14 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 125.394 1.478 . . . . 0.0 112.649 159.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -88.49 114.74 25.42 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -71.98 -20.28 61.75 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.11 0.564 . . . . 0.0 111.847 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -68.47 -27.63 66.33 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.022 0.529 . . . . 0.0 110.225 170.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -74.27 87.6 1.98 Allowed 'General case' 0 C--N 1.354 0.779 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.7 m -115.63 136.57 52.93 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.64 0.776 . . . . 0.0 110.172 -172.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -137.12 151.15 48.52 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.869 1.268 . . . . 0.0 107.582 173.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.613 ' HB3' ' HG2' ' A' ' 29' ' ' ARG . 11.0 pt-20 -131.3 126.35 35.13 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.6 p -135.23 147.72 29.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.798 -172.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.8 m -92.77 110.81 22.26 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.57 0.748 . . . . 0.0 109.042 -178.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 32.7 tp -110.26 130.79 55.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.328 1.051 . . . . 0.0 109.594 175.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 20.8 t -75.41 145.76 41.32 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.63 ' HA ' ' HG2' ' A' ' 82' ' ' PRO . 14.4 ptm180 -62.63 -21.36 65.62 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -172.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -106.17 -7.86 17.68 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.905 0.882 . . . . 0.0 111.849 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.9 m -90.37 134.54 30.97 Favored Pre-proline 0 CA--C 1.543 0.689 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 177.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.532 ' HB2' ' HG3' ' A' ' 50' ' ' LYS . 8.1 Cg_exo -63.5 155.35 63.09 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.899 2.4 . . . . 0.0 113.403 -178.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 53' ' ' MET . 4.0 mm? -53.28 -30.36 38.2 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 124.561 1.145 . . . . 0.0 111.874 173.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.532 ' HG3' ' HB2' ' A' ' 48' ' ' PRO . 0.0 OUTLIER -57.85 -37.05 73.17 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.077 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.507 HG22 ' O ' ' A' ' 48' ' ' PRO . 6.5 t -68.52 -33.47 74.17 Favored 'General case' 0 CA--C 1.561 1.367 0 CA-C-O 121.053 0.454 . . . . 0.0 110.759 179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 tt -70.61 -38.33 73.97 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.718 1.207 . . . . 0.0 110.177 173.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.477 ' HG3' ' O ' ' A' ' 49' ' ' LEU . 62.2 mtt -60.5 -40.02 89.85 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.212 1.005 . . . . 0.0 111.155 177.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 50.4 m -65.49 -38.44 89.75 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 124.477 1.111 . . . . 0.0 110.182 175.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -67.33 -47.55 70.16 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 122.611 0.364 . . . . 0.0 110.409 -176.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.5 -55.83 27.28 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.406 0.682 . . . . 0.0 111.677 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.52 -38.15 88.85 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 123.674 0.609 . . . . 0.0 112.149 -175.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -66.81 -47.75 71.07 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.569 0.348 . . . . 0.0 111.612 176.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.76 -48.48 74.4 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.113 0.965 . . . . 0.0 112.185 -177.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.424 ' HB3' HD23 ' A' ' 62' ' ' LEU . 35.8 tpp -81.55 17.32 1.44 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 124.217 1.007 . . . . 0.0 112.431 -171.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 55.71 26.87 47.88 Favored Glycine 0 C--N 1.353 1.48 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 -176.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 60' ' ' MET . 3.6 mm? -85.76 22.48 1.63 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.051 0.94 . . . . 0.0 111.747 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.5 p -72.38 87.55 1.16 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.765 0.826 . . . . 0.0 110.381 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.54 -48.76 0.09 OUTLIER Glycine 0 C--N 1.343 0.95 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.756 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 55.2 ttp180 -132.68 134.63 45.06 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.124 0.969 . . . . 0.0 108.753 177.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.6 tttp -83.58 138.7 33.26 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 176.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.475 ' N ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -116.98 156.98 26.53 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.622 1.169 . . . . 0.0 109.921 -171.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.493 ' HB3' ' HE3' ' A' ' 75' ' ' LYS . 74.9 m -99.39 175.08 5.98 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.498 0.719 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -141.51 139.03 33.18 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.448 1.099 . . . . 0.0 109.553 -163.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -123.28 143.45 50.05 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.0 0.92 . . . . 0.0 110.664 174.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.528 ' HB3' HD21 ' A' ' 76' ' ' LEU . 66.4 t80 -129.6 106.12 8.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 171.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 61.12 26.94 16.8 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.445 1.098 . . . . 0.0 110.761 -170.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 90.55 -13.12 66.35 Favored Glycine 0 C--N 1.349 1.278 0 CA-C-N 115.635 -0.712 . . . . 0.0 113.595 -176.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 72.6 m -68.5 126.68 30.42 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.444 0.698 . . . . 0.0 110.874 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.493 ' HE3' ' HB3' ' A' ' 68' ' ' SER . 21.7 tptm -68.85 113.2 6.06 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 123.714 0.634 . . . . 0.0 109.896 178.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.528 HD21 ' HB3' ' A' ' 71' ' ' PHE . 23.5 mt -88.13 111.4 21.54 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 174.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.9 t -80.58 -18.44 48.28 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.987 0.915 . . . . 0.0 111.04 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 119.38 -39.5 2.49 Favored Glycine 0 C--N 1.347 1.159 0 C-N-CA 123.094 0.378 . . . . 0.0 113.295 177.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -81.88 1.57 34.42 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.261 0.624 . . . . 0.0 112.0 -173.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -80.41 148.68 30.46 Favored 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 39.5 mt -101.67 153.38 37.95 Favored Pre-proline 0 C--N 1.306 -1.288 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 174.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.63 ' HG2' ' HA ' ' A' ' 45' ' ' ARG . 58.0 Cg_endo -66.81 -22.19 49.75 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.783 1.656 . . . . 0.0 111.354 176.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.81 98.3 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.669 0.787 . . . . 0.0 110.979 168.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -71.86 -45.49 61.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.925 0.89 . . . . 0.0 110.999 -177.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.8 mt -75.8 -11.23 59.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.691 0.796 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 77.29 26.82 60.87 Favored Glycine 0 C--N 1.35 1.351 0 CA-C-N 116.946 -0.115 . . . . 0.0 113.238 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.432 ' HE1' HD11 ' A' ' 49' ' ' LEU . 61.2 mtt -73.0 161.85 30.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.022 0.929 . . . . 0.0 111.365 177.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -149.31 160.5 43.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.122 1.369 . . . . 0.0 107.696 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.9 t -60.07 111.74 1.62 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 176.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 129.65 -28.43 3.98 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-O 119.498 -0.612 . . . . 0.0 112.819 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.92 170.95 0.07 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 39.6 tp -132.55 109.58 9.87 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.812 -167.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.8 mt -96.41 152.79 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 124.235 1.014 . . . . 0.0 108.663 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -124.3 163.02 22.55 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -173.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.63 ' HB ' ' HA2' ' A' ' 32' ' ' GLY . 75.7 t -142.13 112.86 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 123.832 0.853 . . . . 0.0 109.231 -175.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.9 p-90 -103.71 143.39 32.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 172.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.275 0 CA-C-O 118.923 -0.932 . . . . 0.0 112.098 178.952 . . . . . . . . 0 0 . 1 stop_ save_