data_1yx5_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 1yx5 _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 ' 63' ' ' ASP . . . . . . . . . . . . . 1.7 t0 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.31 0.576 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.18 -27.11 60.66 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.22 -0.925 . . . . 0.0 109.084 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.39 -42.17 99.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.629 -0.829 . . . . 0.0 108.807 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.54 -30.38 70.67 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 tt -77.1 -35.22 56.56 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.569 -0.707 . . . . 0.0 109.774 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.79 -55.91 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.337 -179.907 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -44.29 67.19 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 110.536 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.2 m -67.06 -44.69 79.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.409 -0.807 . . . . 0.0 110.618 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.8 tp -80.52 -12.08 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.275 -0.891 . . . . 0.0 110.259 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.6 m -76.05 -41.52 50.45 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -82.26 -24.56 34.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.452 -0.78 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.309 -0.869 . . . . 0.0 110.366 -179.98 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.9 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.368 0.604 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.565 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.3 pt-20 -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.538 -0.726 . . . . 0.0 109.268 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.407 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.6 mt-10 -85.43 -40.07 16.84 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.01 -42.73 97.05 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -69.57 -34.9 74.83 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.565 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.67 -37.15 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.879 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.79 -34.87 79.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -77.82 -44.59 26.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.565 -0.709 . . . . 0.0 109.926 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.86 -33.38 72.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.369 -0.832 . . . . 0.0 110.065 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.9 tpp -80.58 -21.91 41.21 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.801 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.459 -0.775 . . . . 0.0 110.028 179.847 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.43 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.9 ttp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.131 0.491 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -89.98 139.87 30.19 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.335 -0.853 . . . . 0.0 109.779 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 21.9 pt -137.56 159.64 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.915 . . . . 0.0 110.353 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.92 143.54 42.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.713 -0.617 . . . . 0.0 110.517 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 65.0 t -128.02 121.07 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.321 -0.862 . . . . 0.0 109.854 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 mtpt -99.98 128.13 46.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.181 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.7 p -95.9 177.27 5.82 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.485 -0.759 . . . . 0.0 110.506 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.436 ' N ' ' CD2' ' B' ' 8' ' ' LEU . 4.6 mm? -61.35 -14.46 27.46 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.557 -0.714 . . . . 0.0 110.956 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.7 p -95.61 17.74 14.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.154 -0.966 . . . . 0.0 110.683 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.12 11.06 58.11 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -85.0 132.63 34.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.08 -1.247 . . . . 0.0 109.816 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -113.19 125.19 54.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.396 -0.815 . . . . 0.0 110.273 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.447 HD12 HG22 ' B' ' 13' ' ' ILE . 21.7 mt -109.31 135.4 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 110.405 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.3 m -102.32 118.48 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.194 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -123.5 164.22 19.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.229 -0.92 . . . . 0.0 110.916 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -106.38 116.99 32.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.495 -0.753 . . . . 0.0 109.423 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.43 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.7 m -140.17 174.98 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.841 . . . . 0.0 110.746 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -113.1 165.81 12.43 Favored Pre-proline 0 N--CA 1.488 1.444 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.69 -26.13 16.53 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 123.617 1.325 . . . . 0.0 110.398 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.51 -4.0 58.71 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.057 -1.027 . . . . 0.0 110.508 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.22 138.84 49.82 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.54 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 68.0 p -83.37 160.24 21.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.482 -0.761 . . . . 0.0 110.248 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.412 HG12 ' CB ' ' B' ' 50' ' ' LEU . 1.7 mp -59.22 -28.98 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.93 -40.51 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 109.38 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -70.14 -31.36 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.544 -0.722 . . . . 0.0 109.483 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 81.8 t -70.16 -40.97 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.773 . . . . 0.0 109.27 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -62.99 -42.98 99.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.406 -0.809 . . . . 0.0 109.238 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -34.29 75.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.47 -0.769 . . . . 0.0 109.475 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 21.9 mttp -68.03 -39.97 83.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.524 -0.735 . . . . 0.0 109.674 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 18.7 mt -67.15 -37.68 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 0.0 109.071 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -52.08 66.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.813 . . . . 0.0 109.68 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -58.13 -27.63 63.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.451 -0.781 . . . . 0.0 110.643 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.03 -38.2 21.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.164 -0.96 . . . . 0.0 110.854 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -108.07 -56.43 2.24 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.226 -0.921 . . . . 0.0 110.502 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.15 17.64 1.98 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 19.9 mt -91.44 143.59 28.39 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.076 -1.249 . . . . 0.0 109.785 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.413 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -67.66 133.44 29.72 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.65 1.342 . . . . 0.0 110.415 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.69 -26.7 83.47 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.732 1.386 . . . . 0.0 110.849 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -24.89 64.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.84 . . . . 0.0 109.956 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.413 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.1 mt-30 -101.31 3.11 40.4 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.348 -0.845 . . . . 0.0 110.465 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -94.17 137.65 33.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.124 -0.985 . . . . 0.0 110.327 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -130.06 129.52 43.73 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.429 -0.794 . . . . 0.0 109.863 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 13.9 mt -104.45 116.89 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.397 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.417 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 2.0 mp -121.37 135.36 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.482 -0.761 . . . . 0.0 109.675 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -141.12 154.06 45.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 26.73 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.481 -0.762 . . . . 0.0 111.329 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.99 -3.74 74.54 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.159 -1.02 . . . . 0.0 110.621 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 136.93 49.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.976 -1.308 . . . . 0.0 110.31 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.29 134.92 37.45 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.21 -0.931 . . . . 0.0 109.832 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.449 HD21 ' CE2' ' B' ' 59' ' ' TYR . 26.7 mt -83.96 144.77 28.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -93.65 130.59 39.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.378 -0.826 . . . . 0.0 110.433 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -48.58 -26.83 2.41 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.522 -0.736 . . . . 0.0 111.435 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.64 -5.16 89.72 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -99.6 157.91 16.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.076 -1.249 . . . . 0.0 110.45 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 65.2 p -102.63 161.5 13.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.82 . . . . 0.0 110.212 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.7 mt -53.63 -47.34 70.36 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.389 -0.819 . . . . 0.0 110.626 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.8 t -56.74 -37.0 70.4 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.432 -0.793 . . . . 0.0 111.17 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.33 -26.62 65.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.147 -0.971 . . . . 0.0 110.24 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.449 ' CE2' HD21 ' B' ' 50' ' ' LEU . 25.3 m-85 -101.04 27.16 6.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.379 -0.826 . . . . 0.0 109.829 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.64 28.01 3.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.444 -0.785 . . . . 0.0 110.688 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.444 HD13 HG22 ' B' ' 61' ' ' ILE . 88.8 mt -81.56 112.01 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.362 -0.836 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -105.66 171.7 7.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' B' ' 64' ' ' GLU . 0.9 OUTLIER -46.62 157.18 0.15 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.514 -0.741 . . . . 0.0 111.268 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.537 ' HG3' ' O ' ' B' ' 64' ' ' GLU . 0.0 OUTLIER 63.81 8.36 3.76 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.791 177.322 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -71.54 142.36 50.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.018 -1.051 . . . . 0.0 110.153 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 23.4 m -107.77 113.51 26.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.36 -0.837 . . . . 0.0 109.973 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 mt -102.18 164.18 11.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.33 -0.856 . . . . 0.0 110.048 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -108.58 128.87 55.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.32 -0.863 . . . . 0.0 109.959 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 48.0 tp -107.02 132.71 52.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.277 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 41.5 t . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.375 -0.828 . . . . 0.0 110.181 179.92 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.339 0.59 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -75.31 -28.44 59.68 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.234 -0.916 . . . . 0.0 109.191 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.19 82.06 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.692 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -31.58 68.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.58 -42.58 58.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.479 -0.763 . . . . 0.0 109.511 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.2 OUTLIER -78.42 -53.06 7.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.471 -0.768 . . . . 0.0 110.321 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 ttp -53.55 -40.99 66.01 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.204 -0.935 . . . . 0.0 110.524 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.2 m -64.78 -47.38 78.34 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.6 tp -82.45 -11.69 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.9 . . . . 0.0 110.391 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 31.8 t -72.9 -46.85 50.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 109.8 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -81.85 -26.28 34.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.812 . . . . 0.0 109.908 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.318 -0.864 . . . . 0.0 110.245 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.313 0.578 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.55 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 pt-20 -69.39 -31.08 69.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.484 -0.76 . . . . 0.0 109.114 179.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.415 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.6 OUTLIER -85.27 -39.54 17.62 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -63.92 -46.08 86.39 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -65.63 -34.22 77.73 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.55 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.2 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.71 90.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.506 -0.746 . . . . 0.0 109.722 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -44.56 93.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.419 -0.801 . . . . 0.0 110.051 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.67 -31.1 61.81 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.863 . . . . 0.0 110.361 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.0 tpt -83.42 -24.97 31.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.367 -0.833 . . . . 0.0 110.023 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.0 110.081 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.342 0.592 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -103.07 147.03 27.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.0 110.109 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 38.3 pt -137.52 158.28 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.4 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 79.5 m-85 -111.99 143.84 42.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.598 -0.689 . . . . 0.0 110.613 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 63.8 t -127.89 120.75 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.46 -0.775 . . . . 0.0 109.491 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.1 mtpt -100.03 129.81 46.12 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.409 -0.807 . . . . 0.0 110.568 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 32.2 p -95.81 175.98 6.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.401 -0.812 . . . . 0.0 110.283 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.438 ' N ' ' CD2' ' B' ' 8' ' ' LEU . 4.5 mm? -61.16 -15.97 39.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.794 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.4 p -95.96 20.45 10.03 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.097 -1.002 . . . . 0.0 110.765 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.87 13.78 59.86 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.5 tttp -84.76 130.09 34.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.051 -1.264 . . . . 0.0 109.768 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.1 m -113.05 124.96 53.83 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.143 -0.973 . . . . 0.0 110.439 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 6.5 mt -109.32 133.23 55.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.409 -0.807 . . . . 0.0 110.259 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.4 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 11.7 m -102.38 118.76 37.55 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.371 -0.831 . . . . 0.0 109.564 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 67.9 mt -123.42 168.69 12.22 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.218 -0.926 . . . . 0.0 110.792 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.61 116.03 31.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.399 -0.813 . . . . 0.0 109.642 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.43 169.77 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.696 -179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -112.62 166.07 11.77 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.57 -0.706 . . . . 0.0 109.294 178.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.16 -25.63 18.82 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 123.538 1.283 . . . . 0.0 110.313 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -84.33 -3.56 58.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.506 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.21 141.41 50.63 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.178 -0.951 . . . . 0.0 110.465 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 46.4 p -83.17 157.13 22.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.54 -0.725 . . . . 0.0 110.367 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.413 HG23 HD12 ' B' ' 23' ' ' ILE . 43.0 mm -59.55 -35.3 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.292 -0.88 . . . . 0.0 109.435 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.16 -37.26 79.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.458 -0.776 . . . . 0.0 109.276 179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.32 -30.15 67.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.553 -0.717 . . . . 0.0 109.296 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.54 -41.44 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.468 -0.77 . . . . 0.0 109.16 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -62.85 -43.82 97.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.403 -0.81 . . . . 0.0 109.151 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -31.71 71.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.73 . . . . 0.0 109.289 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -68.35 -40.36 81.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.556 -0.715 . . . . 0.0 109.363 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.8 mt -67.09 -37.56 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.024 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 54.9 tt0 -60.78 -51.76 67.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.376 -0.827 . . . . 0.0 109.631 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.15 -27.1 63.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.433 -0.792 . . . . 0.0 110.592 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.93 -41.72 17.07 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.294 -0.879 . . . . 0.0 110.865 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -108.13 -53.72 2.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.217 -0.927 . . . . 0.0 110.427 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.5 19.74 2.04 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.151 -1.18 . . . . 0.0 110.151 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 51.8 mt -91.39 143.42 28.18 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.108 -1.231 . . . . 0.0 109.823 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.443 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.5 Cg_endo -69.69 133.04 24.74 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.663 1.349 . . . . 0.0 110.437 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.84 -25.78 81.86 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 O-C-N 123.705 1.371 . . . . 0.0 110.845 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -68.78 -25.2 64.58 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.304 -0.873 . . . . 0.0 109.88 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 29.5 mm-40 -101.33 5.16 42.19 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.433 -0.792 . . . . 0.0 110.46 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -94.26 141.82 28.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.0 110.425 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.12 124.46 32.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.447 -0.783 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 28.1 mt -104.6 118.19 35.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.217 -0.927 . . . . 0.0 110.274 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.403 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 1.8 mp -120.89 133.04 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.571 -0.706 . . . . 0.0 109.714 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -140.87 147.21 38.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.429 -0.794 . . . . 0.0 110.064 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.27 28.79 0.47 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.76 . . . . 0.0 111.191 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.49 2.91 85.72 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -111.13 134.79 52.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.045 -1.268 . . . . 0.0 110.243 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -78.46 134.46 37.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 109.406 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.445 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 35.0 mt -83.88 137.07 33.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.239 -0.913 . . . . 0.0 110.361 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -93.76 130.64 39.67 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.791 . . . . 0.0 110.41 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.408 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.39 -26.87 2.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.494 -0.754 . . . . 0.0 111.211 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.81 86.69 Favored Glycine 0 N--CA 1.494 2.547 0 C-N-CA 120.046 -1.073 . . . . 0.0 110.608 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -99.42 156.28 17.1 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.045 -1.268 . . . . 0.0 110.483 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.6 p -102.42 163.84 12.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.373 -0.829 . . . . 0.0 110.158 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 85.6 mt -53.5 -44.47 69.11 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.313 -0.867 . . . . 0.0 110.465 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 27.4 p -56.86 -36.31 69.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.398 -0.814 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.59 -27.96 66.73 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.099 -1.001 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.445 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 50.4 m-85 -101.13 27.54 6.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 109.93 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 50.6 28.2 3.34 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.604 -0.685 . . . . 0.0 110.683 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.438 HG23 HD13 ' B' ' 61' ' ' ILE . 90.9 mt -81.54 108.87 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.93 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.58 174.68 5.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.344 -0.847 . . . . 0.0 110.065 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.56 153.37 0.38 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.465 -0.772 . . . . 0.0 111.022 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 7.6 mt-10 62.64 16.32 8.77 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.667 -0.645 . . . . 0.0 110.681 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.55 142.05 50.08 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 20.3 m -107.64 109.93 21.67 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.334 -0.854 . . . . 0.0 110.115 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 mt -102.54 160.72 14.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.84 . . . . 0.0 110.101 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -108.83 132.66 53.79 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.306 -0.871 . . . . 0.0 110.043 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.7 tp -107.28 129.38 54.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.305 -0.872 . . . . 0.0 110.184 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.46 -0.775 . . . . 0.0 110.071 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t70 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.219 0.533 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -77.67 -28.67 51.2 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.183 -0.948 . . . . 0.0 109.517 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.26 79.89 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.414 -0.915 . . . . 0.0 108.786 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.414 ' O ' ' CG2' ' A' ' 70' ' ' THR . 14.1 tp -73.04 -30.94 64.11 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -77.55 -34.35 53.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.595 -0.69 . . . . 0.0 109.669 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.406 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.1 OUTLIER -84.63 -51.29 6.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 109.926 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.33 -38.62 63.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.275 -0.891 . . . . 0.0 110.425 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.414 ' CG2' ' O ' ' A' ' 66' ' ' LEU . 14.4 t -74.59 -36.27 63.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.243 -0.911 . . . . 0.0 110.474 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.4 tp -85.45 -14.01 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.387 -0.821 . . . . 0.0 110.323 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' LYS . 35.5 t -83.82 -33.41 24.93 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.926 . . . . 0.0 109.992 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.86 -24.31 19.38 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.299 -0.876 . . . . 0.0 110.185 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.32 -0.863 . . . . 0.0 110.232 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.481 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 77.4 p . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.421 0.629 . . . . 0.0 110.426 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.584 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 2.8 mt-10 -73.53 -29.85 62.72 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.559 -0.713 . . . . 0.0 109.077 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.402 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 31.7 mt-10 -85.09 -36.97 20.81 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.481 ' HB2' ' N ' ' A' ' 88' ' ' THR . 7.8 mm-40 -66.19 -45.27 81.42 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -66.47 -34.79 78.73 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.584 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -65.61 -36.24 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 178.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.41 71.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.494 -0.754 . . . . 0.0 109.613 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -84.52 -46.13 11.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.462 -0.774 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.44 -30.92 67.89 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.417 -0.802 . . . . 0.0 110.505 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.4 ttm -82.3 -25.52 33.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.285 -0.884 . . . . 0.0 109.971 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 110.147 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.137 0.494 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.24 140.71 29.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.797 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.8 pt -137.38 159.79 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.906 . . . . 0.0 110.291 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.98 143.62 42.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.576 -0.703 . . . . 0.0 110.686 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 82.4 t -127.72 116.87 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.447 -0.783 . . . . 0.0 109.352 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -100.18 131.87 45.87 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.345 -0.847 . . . . 0.0 110.813 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 17.5 p -95.99 173.34 7.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.878 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.66 -12.01 14.31 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.343 -0.848 . . . . 0.0 110.941 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 63.8 p -95.65 16.06 18.31 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.036 -1.04 . . . . 0.0 110.767 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.36 8.59 66.46 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 120.195 -1.003 . . . . 0.0 110.629 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -84.75 127.27 34.03 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.052 -1.264 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 3.5 m -113.24 126.84 55.85 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.977 . . . . 0.0 110.495 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 13.1 mt -109.46 136.67 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.358 -0.839 . . . . 0.0 110.439 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m -102.3 120.52 40.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.1 mt -123.49 162.22 23.31 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.117 -0.99 . . . . 0.0 110.857 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -106.55 116.15 31.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.475 -0.765 . . . . 0.0 109.664 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.424 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.24 176.45 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 110.787 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -113.14 163.24 18.62 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.44 -26.69 20.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.513 1.27 . . . . 0.0 110.276 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 m -84.54 -2.48 57.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.261 -0.9 . . . . 0.0 110.614 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -71.36 145.15 49.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.541 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.33 156.33 23.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.661 -0.65 . . . . 0.0 110.432 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.403 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.7 mm -59.61 -32.75 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 109.431 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -62.58 -36.74 83.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -70.21 -31.51 68.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.514 -0.742 . . . . 0.0 109.124 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.99 -40.37 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttt -62.92 -40.6 98.12 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -34.75 76.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 109.348 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.9 -39.99 83.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.571 -0.706 . . . . 0.0 109.554 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.0 mt -67.31 -37.62 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.152 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.4 tm0? -60.87 -53.33 58.62 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.469 -0.769 . . . . 0.0 109.833 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.1 -27.73 63.98 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.386 -0.821 . . . . 0.0 110.746 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -84.12 -36.52 22.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 111.167 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -108.07 -53.14 2.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.202 -0.936 . . . . 0.0 110.602 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.61 14.15 3.6 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 69.2 mt -91.37 143.25 27.94 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.107 -1.231 . . . . 0.0 109.874 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 38.7 Cg_endo -67.4 135.39 36.43 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.61 1.321 . . . . 0.0 110.391 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 -24.74 79.32 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.727 1.383 . . . . 0.0 111.001 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.73 -25.38 64.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.317 -0.865 . . . . 0.0 109.804 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.529 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.58 6.87 44.27 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.533 -0.73 . . . . 0.0 110.541 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -94.3 139.52 30.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.445 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.1 122.82 29.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.452 -0.78 . . . . 0.0 109.845 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 28.0 mt -104.7 116.69 32.47 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.481 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.412 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 1.9 mp -121.12 133.78 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.553 -0.717 . . . . 0.0 109.658 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -140.39 151.64 45.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.458 -0.776 . . . . 0.0 109.807 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.38 28.14 0.44 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.472 -0.768 . . . . 0.0 111.048 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.52 2.31 79.72 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -111.13 138.3 47.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.246 . . . . 0.0 110.292 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -78.39 135.88 37.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.9 . . . . 0.0 109.459 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.433 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 39.8 mt -83.79 138.45 33.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 110.315 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -93.67 127.76 39.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.387 -0.821 . . . . 0.0 110.6 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.33 -26.42 2.02 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 111.135 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -10.45 82.95 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.733 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.25 158.3 15.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.31 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 41.3 p -102.39 166.15 10.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.768 . . . . 0.0 110.373 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.4 mt -53.64 -44.21 69.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.317 -0.864 . . . . 0.0 110.751 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 94.0 p -56.83 -36.77 70.36 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.342 -0.849 . . . . 0.0 111.153 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.55 -27.06 65.89 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.135 -0.978 . . . . 0.0 110.532 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.433 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 55.2 m-85 -101.06 24.72 8.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.883 . . . . 0.0 110.221 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 50.69 30.33 4.86 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.4 -0.813 . . . . 0.0 110.723 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.464 HD11 HG23 ' B' ' 61' ' ' ILE . 73.5 mt -81.67 113.45 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.29 -0.881 . . . . 0.0 110.015 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.78 170.47 7.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.9 . . . . 0.0 110.262 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -46.74 153.28 0.41 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.568 -0.707 . . . . 0.0 111.103 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 62.84 16.1 8.8 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.611 -0.68 . . . . 0.0 110.874 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.56 144.59 49.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.153 -0.967 . . . . 0.0 110.082 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.7 m -107.53 110.49 22.43 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -102.42 162.62 12.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.368 -0.832 . . . . 0.0 110.213 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -109.03 130.58 55.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.363 -0.835 . . . . 0.0 109.941 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 55.0 tp -106.97 127.75 53.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 48.6 t . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.303 -0.873 . . . . 0.0 110.136 -179.973 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.218 0.532 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -75.9 -29.78 58.58 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.239 -0.913 . . . . 0.0 109.163 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.84 -36.29 82.73 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.434 -0.906 . . . . 0.0 108.69 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -29.09 64.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.5 tt -78.73 -37.68 40.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.51 -0.744 . . . . 0.0 109.803 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -84.04 -50.71 7.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.5 -0.75 . . . . 0.0 110.38 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.3 tpp -57.64 -42.97 84.52 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.264 -0.898 . . . . 0.0 110.438 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.8 m -68.35 -41.73 80.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.337 -0.852 . . . . 0.0 110.571 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.3 tp -82.95 -14.98 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.253 -0.904 . . . . 0.0 110.28 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' LYS . 8.2 t -74.15 -45.33 49.43 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.889 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -79.59 -26.42 41.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.44 -0.788 . . . . 0.0 109.956 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.347 -0.846 . . . . 0.0 110.153 179.907 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.365 0.602 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.56 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.1 mt-10 -71.92 -30.32 65.23 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mm-40 -83.85 -38.07 21.66 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -45.24 85.3 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.07 -34.2 77.52 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.56 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -67.37 -33.67 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.74 -28.9 69.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.398 -0.814 . . . . 0.0 109.8 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.78 -39.31 20.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.411 -0.806 . . . . 0.0 110.355 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.95 -29.3 32.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.282 -0.886 . . . . 0.0 110.724 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 tpt -82.27 -27.47 32.38 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 . . . . . 0 N--CA 1.488 1.433 0 O-C-N 121.478 -0.764 . . . . 0.0 109.764 179.695 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.461 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.0 ttp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.213 0.53 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -88.21 138.69 31.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 109.855 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.6 pt -137.42 158.82 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.343 -0.848 . . . . 0.0 110.365 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.421 ' CE1' HG23 ' B' ' 14' ' ' THR . 83.7 m-85 -111.84 142.55 44.07 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.616 -0.677 . . . . 0.0 110.628 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t -127.97 119.59 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.383 -0.823 . . . . 0.0 109.507 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.409 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.7 mtpm? -100.32 131.15 46.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.803 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.2 p -96.21 176.86 5.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 110.18 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.62 -15.08 36.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.449 -0.782 . . . . 0.0 110.954 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 78.0 p -95.8 19.88 10.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.041 -1.037 . . . . 0.0 110.767 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.91 12.83 58.26 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.409 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.06 34.86 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.242 . . . . 0.0 109.729 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 25.1 m -112.88 126.75 55.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.273 -0.892 . . . . 0.0 110.42 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.3 mt -109.31 138.54 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.39 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.421 HG23 ' CE1' ' B' ' 4' ' ' PHE . 4.3 m -101.93 119.71 39.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.0 109.13 179.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.0 mt -123.47 160.68 26.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.055 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 114.91 29.32 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.527 -0.733 . . . . 0.0 109.409 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.461 ' O ' ' HB3' ' B' ' 1' ' ' MET . 28.4 m -140.16 176.99 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 110.882 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -113.29 164.21 16.26 Favored Pre-proline 0 N--CA 1.49 1.536 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.9 -26.07 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 123.543 1.286 . . . . 0.0 110.346 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 -3.13 58.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.212 -0.93 . . . . 0.0 110.739 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.27 144.1 50.14 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.139 -0.976 . . . . 0.0 110.617 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 67.5 p -83.15 158.48 22.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.535 -0.728 . . . . 0.0 110.206 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.448 HG23 HD12 ' B' ' 23' ' ' ILE . 43.7 mm -59.58 -36.97 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 109.542 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.74 -35.46 76.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.453 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -70.44 -32.99 70.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.468 -0.77 . . . . 0.0 109.351 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.94 -39.8 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.0 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.6 mtmt -62.99 -41.19 99.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 109.036 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.42 77.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.573 -0.704 . . . . 0.0 109.391 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -37.5 81.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.437 -0.789 . . . . 0.0 109.388 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.4 mt -67.18 -37.46 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.769 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -60.71 -51.28 70.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.549 -0.719 . . . . 0.0 109.531 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -58.13 -27.25 63.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.55 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -84.07 -39.47 19.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.214 -0.929 . . . . 0.0 110.841 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -108.16 -55.75 2.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.249 -0.907 . . . . 0.0 110.6 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.2 14.24 2.03 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.411 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 13.8 mt -91.17 143.81 28.95 Favored Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.115 -1.227 . . . . 0.0 109.573 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.411 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 40.7 Cg_endo -68.38 131.74 23.99 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 O-C-N 123.631 1.332 . . . . 0.0 110.6 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.01 -25.41 81.44 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.719 1.378 . . . . 0.0 110.777 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -68.69 -24.13 64.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 109.768 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -101.19 2.59 40.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.455 -0.778 . . . . 0.0 110.427 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -94.35 141.95 27.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.234 -0.916 . . . . 0.0 110.473 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.36 131.77 45.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.529 -0.732 . . . . 0.0 109.801 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.62 120.86 42.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.349 -0.844 . . . . 0.0 110.467 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.402 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 1.8 mp -121.08 133.01 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.496 -0.753 . . . . 0.0 109.65 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -140.65 150.66 43.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.416 -0.803 . . . . 0.0 110.16 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.68 0.46 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.457 -0.777 . . . . 0.0 111.217 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.48 80.27 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -110.97 137.46 48.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.968 -1.313 . . . . 0.0 110.239 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.49 134.35 37.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.397 -0.814 . . . . 0.0 109.688 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.465 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 31.9 mt -83.8 141.04 31.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.232 -0.917 . . . . 0.0 110.306 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -93.49 129.32 39.73 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.358 -0.839 . . . . 0.0 110.524 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.413 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 73.1 m-20 -48.29 -26.11 1.86 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.734 . . . . 0.0 111.229 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.78 -9.31 84.72 Favored Glycine 0 N--CA 1.493 2.482 0 C-N-CA 120.139 -1.029 . . . . 0.0 110.553 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -99.35 156.8 16.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.994 -1.297 . . . . 0.0 110.483 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 31.8 p -102.38 167.65 9.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 110.181 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 86.6 mt -53.69 -47.02 70.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.255 -0.903 . . . . 0.0 110.629 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.76 -34.71 67.85 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.368 -0.833 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.63 -29.46 68.03 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.152 -0.967 . . . . 0.0 110.384 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.465 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 47.3 m-85 -101.24 28.97 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.835 . . . . 0.0 109.867 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.69 28.43 3.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.593 -0.692 . . . . 0.0 110.785 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.47 HD11 HG23 ' B' ' 61' ' ' ILE . 97.4 mt -81.36 108.54 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 109.741 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -105.73 173.53 6.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.379 -0.826 . . . . 0.0 110.366 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.4 OUTLIER -46.55 152.36 0.47 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.526 -0.734 . . . . 0.0 110.933 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.6 mm-40 62.97 15.87 8.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.701 -0.624 . . . . 0.0 110.59 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 144.93 49.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 0.0 110.079 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -107.56 106.83 17.38 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.33 -0.856 . . . . 0.0 109.929 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 mt -102.57 160.49 14.52 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -108.88 135.91 49.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -0.885 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.2 tp -107.13 131.65 53.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.291 -0.881 . . . . 0.0 110.411 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 19.4 t . . . . . 0 N--CA 1.493 1.691 0 O-C-N 121.395 -0.816 . . . . 0.0 110.121 179.894 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.293 0.568 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.38 -32.48 58.59 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.205 -0.934 . . . . 0.0 109.21 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.69 80.86 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 108.901 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mp -70.16 -30.68 67.88 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.407 ' CD1' ' C ' ' A' ' 67' ' ' LEU . 3.1 tm? -73.87 -42.95 60.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.453 -0.779 . . . . 0.0 109.46 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -80.41 -53.25 6.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.424 -0.797 . . . . 0.0 110.599 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -53.77 -38.51 64.51 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.109 -0.995 . . . . 0.0 110.623 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 47.3 m -70.31 -41.36 73.4 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.264 -0.898 . . . . 0.0 110.494 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.8 tp -84.34 -14.55 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.173 -0.954 . . . . 0.0 110.368 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -75.66 -44.67 41.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.284 -0.885 . . . . 0.0 109.658 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -79.06 -27.04 43.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.483 -0.761 . . . . 0.0 109.967 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 . . . . . 0 N--CA 1.493 1.677 0 O-C-N 121.359 -0.838 . . . . 0.0 110.229 179.937 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.35 0.595 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.581 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.5 pt-20 -66.07 -33.55 76.04 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.445 -0.784 . . . . 0.0 109.456 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -85.2 -39.73 17.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.662 -0.649 . . . . 0.0 109.543 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.12 -41.67 90.21 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -69.98 -34.63 73.61 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -58.76 -34.97 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.71 61.88 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.57 -0.706 . . . . 0.0 109.519 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.71 -34.12 77.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.519 -0.738 . . . . 0.0 109.943 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.77 -37.2 41.64 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.411 -0.805 . . . . 0.0 110.071 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.7 tpp -81.15 -25.95 36.46 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.286 -0.884 . . . . 0.0 109.79 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.414 -0.804 . . . . 0.0 109.82 179.88 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.444 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 39.3 ttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.339 0.59 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -120.44 139.17 53.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.486 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 45.0 pt -137.55 158.33 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.223 -0.923 . . . . 0.0 110.514 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -111.78 145.56 39.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.608 -0.683 . . . . 0.0 110.297 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 60.7 t -128.18 122.63 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.373 -0.829 . . . . 0.0 109.844 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.13 135.9 40.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.358 -0.839 . . . . 0.0 110.182 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.2 p -95.67 171.52 8.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.39 -0.819 . . . . 0.0 110.583 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.437 ' N ' ' CD2' ' B' ' 8' ' ' LEU . 4.5 mm? -61.26 -13.28 17.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.506 -0.746 . . . . 0.0 111.192 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 75.8 p -95.44 -21.06 18.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.119 -0.988 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.89 9.2 14.16 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.941 -1.123 . . . . 0.0 110.394 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 131.76 34.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.071 -1.252 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -113.02 122.24 47.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.121 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mt -109.11 137.0 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.401 -0.812 . . . . 0.0 110.335 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.1 m -102.11 122.14 43.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 82.5 mt -123.44 161.45 24.78 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.171 -0.955 . . . . 0.0 110.806 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -106.25 116.12 31.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.534 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.444 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.9 m -140.03 179.12 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.336 -0.853 . . . . 0.0 110.627 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -113.12 165.18 13.75 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.495 -0.753 . . . . 0.0 109.29 178.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.51 -27.59 15.49 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.593 1.312 . . . . 0.0 110.338 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.44 -2.34 57.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.214 -0.928 . . . . 0.0 110.494 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -71.21 143.27 50.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.23 -0.919 . . . . 0.0 110.44 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 82.5 p -83.22 160.33 21.8 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.513 -0.742 . . . . 0.0 110.261 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.444 HD11 HG23 ' B' ' 23' ' ' ILE . 48.4 mm -59.83 -38.16 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.41 -33.43 72.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 109.365 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -70.32 -35.27 73.54 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.537 -0.727 . . . . 0.0 109.217 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.65 -37.17 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.458 -0.776 . . . . 0.0 108.926 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -63.08 -42.16 99.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.445 -0.784 . . . . 0.0 108.922 178.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.19 75.1 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.606 -0.684 . . . . 0.0 109.325 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -68.35 -38.55 81.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.464 -0.773 . . . . 0.0 109.633 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.9 mt -67.26 -40.93 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 109.223 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -48.68 80.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.421 -0.8 . . . . 0.0 109.497 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.89 -28.03 63.84 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.505 -0.747 . . . . 0.0 110.206 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -83.53 -42.66 16.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 110.146 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -108.33 -118.18 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.444 -0.785 . . . . 0.0 109.743 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.8 23.93 0.22 Allowed Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.783 -1.199 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 81.7 mt -91.88 142.2 26.26 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.205 -1.173 . . . . 0.0 110.21 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.43 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.5 Cg_endo -69.48 134.15 27.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.698 1.367 . . . . 0.0 110.269 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.74 -26.32 82.77 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.717 1.377 . . . . 0.0 110.84 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.79 -24.98 64.48 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.305 -0.872 . . . . 0.0 109.941 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 30.9 mt-30 -101.27 7.38 42.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 110.514 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -94.38 138.05 32.8 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.483 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -130.32 127.81 40.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.449 -0.782 . . . . 0.0 109.627 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -104.49 125.01 50.28 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.35 -0.844 . . . . 0.0 110.609 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.42 ' O ' ' CD2' ' B' ' 68' ' ' HIS . 1.6 mt -122.25 141.11 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.566 -0.709 . . . . 0.0 110.31 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.431 ' CD1' HD11 ' B' ' 67' ' ' LEU . 47.1 t80 -141.65 148.2 38.76 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.25 0.3 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.511 -0.743 . . . . 0.0 111.482 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.21 1.99 90.27 Favored Glycine 0 N--CA 1.495 2.617 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.743 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -110.8 141.89 43.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.924 -1.339 . . . . 0.0 110.296 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -78.35 132.54 37.45 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 109.784 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.453 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 17.9 mt -84.05 142.79 30.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.232 -0.917 . . . . 0.0 110.08 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -93.45 132.75 37.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.358 -0.839 . . . . 0.0 110.406 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.42 -30.45 5.08 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.55 -0.719 . . . . 0.0 111.019 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.81 -2.66 90.67 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.54 153.73 18.81 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.101 -1.235 . . . . 0.0 110.343 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.8 p -102.19 164.18 11.83 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.85 . . . . 0.0 110.103 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -53.58 -47.3 70.25 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.297 -0.877 . . . . 0.0 110.683 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 17.8 p -56.8 -36.04 69.45 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.396 -0.815 . . . . 0.0 111.214 -179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.44 -28.91 67.4 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.124 -0.985 . . . . 0.0 110.403 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 35.9 m-85 -101.19 28.32 5.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.419 -0.8 . . . . 0.0 109.908 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 50.77 28.45 3.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.596 -0.69 . . . . 0.0 110.669 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.452 HD13 HG22 ' B' ' 61' ' ' ILE . 92.4 mt -81.4 108.88 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.253 -0.904 . . . . 0.0 109.764 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -105.45 173.28 6.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.388 -0.82 . . . . 0.0 110.348 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.3 ptmt -46.76 152.77 0.45 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.504 -0.748 . . . . 0.0 111.085 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 63.17 14.98 8.17 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.805 -0.559 . . . . 0.0 111.012 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -71.5 145.25 49.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.012 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.5 m -107.6 109.8 21.53 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.416 -0.803 . . . . 0.0 109.987 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.468 ' N ' ' CD2' ' B' ' 67' ' ' LEU . 2.9 mm? -102.47 160.53 14.47 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.309 -0.87 . . . . 0.0 110.134 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' B' ' 44' ' ' ILE . 9.1 m-70 -108.64 134.62 51.13 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.3 -0.875 . . . . 0.0 109.688 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 35.8 tp -107.15 127.57 53.62 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 110.129 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 44.2 t . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.435 -0.791 . . . . 0.0 110.02 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.139 0.495 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -78.52 -32.28 47.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.212 -0.93 . . . . 0.0 109.131 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.79 -44.67 96.51 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.823 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.43 -29.56 70.61 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.2 tt -75.49 -37.92 59.85 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.518 -0.739 . . . . 0.0 109.785 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -55.43 4.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 110.476 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 ttt -52.87 -41.61 64.47 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 110.687 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 83.7 m -69.01 -40.85 78.43 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.315 -0.866 . . . . 0.0 110.508 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.1 tp -80.07 -18.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.959 . . . . 0.0 109.858 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.93 -38.24 69.89 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.324 -0.86 . . . . 0.0 109.535 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -79.21 -31.78 43.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.461 -0.775 . . . . 0.0 109.673 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.451 -0.781 . . . . 0.0 109.865 179.583 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.2 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.401 0.62 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.533 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 9.6 pt-20 -67.71 -32.23 72.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.468 -0.77 . . . . 0.0 109.258 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -85.35 -39.74 17.3 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.81 -44.78 92.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.13 -35.7 81.19 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.533 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.37 -33.79 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 178.856 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.76 -48.64 78.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 109.875 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -38.52 65.62 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.42 -0.8 . . . . 0.0 109.698 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.2 -37.89 86.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.446 -0.784 . . . . 0.0 109.992 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.5 ttm -80.66 -26.96 37.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.357 -0.839 . . . . 0.0 109.704 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 O-C-N 121.498 -0.751 . . . . 0.0 109.877 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.6 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.164 0.507 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -90.51 139.45 30.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.439 -0.788 . . . . 0.0 109.843 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -137.25 158.43 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.264 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.41 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 82.6 m-85 -111.77 145.11 39.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.646 . . . . 0.0 110.671 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.7 t -128.03 119.44 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 109.53 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -100.26 129.85 46.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.361 -0.837 . . . . 0.0 110.686 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.2 p -96.4 174.81 6.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.437 -0.79 . . . . 0.0 110.067 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mt -61.62 -13.56 23.21 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.312 -0.868 . . . . 0.0 110.841 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 79.0 p -95.57 19.02 11.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.106 -0.997 . . . . 0.0 110.565 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.88 11.57 58.24 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.84 128.28 34.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.068 -1.254 . . . . 0.0 109.952 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.4 m -113.09 124.43 52.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.883 . . . . 0.0 110.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.472 HG22 HD11 ' B' ' 13' ' ' ILE . 22.0 mt -109.14 136.88 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.48 -0.762 . . . . 0.0 110.288 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.41 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 12.0 m -102.29 120.78 41.06 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.529 -0.732 . . . . 0.0 109.502 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 69.8 mt -123.38 162.93 21.8 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 110.963 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.3 115.71 30.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.537 -0.727 . . . . 0.0 109.347 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.424 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.25 174.85 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.285 -0.885 . . . . 0.0 110.863 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -113.14 165.5 13.08 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.41 -24.98 22.01 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 123.507 1.267 . . . . 0.0 110.385 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.0 p -84.6 -4.62 59.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 110.474 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -71.26 139.11 49.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.175 -0.953 . . . . 0.0 110.683 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.556 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 57.6 p -83.67 160.21 21.38 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.51 -0.744 . . . . 0.0 110.495 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.445 HG12 ' HB3' ' B' ' 50' ' ' LEU . 1.7 mp -59.48 -34.88 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.346 -0.846 . . . . 0.0 109.705 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.31 -37.26 80.02 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.371 -0.83 . . . . 0.0 109.386 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -31.48 68.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.463 -0.773 . . . . 0.0 109.203 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.1 t -69.92 -41.64 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.515 -0.741 . . . . 0.0 109.078 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -62.88 -38.95 92.94 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.437 -0.789 . . . . 0.0 108.947 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.79 -36.18 80.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.488 -0.757 . . . . 0.0 109.346 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -68.28 -39.7 82.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 12.5 mt -66.92 -38.87 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.211 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.67 -50.63 72.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.476 -0.765 . . . . 0.0 109.578 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.87 -26.42 62.09 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.401 -0.812 . . . . 0.0 110.236 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -84.27 -40.46 17.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.807 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.99 -55.54 2.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.441 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.19 17.76 1.96 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.405 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 81.1 mt -91.45 144.52 29.78 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.157 -1.202 . . . . 0.0 109.791 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.418 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.9 Cg_endo -70.13 133.48 24.99 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.552 1.291 . . . . 0.0 110.417 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.97 -27.48 84.85 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.736 1.387 . . . . 0.0 111.046 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.83 -22.39 64.24 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.396 -0.815 . . . . 0.0 110.336 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.418 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 41.9 mm-40 -101.29 -2.29 31.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.313 -0.867 . . . . 0.0 110.646 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -94.35 143.42 26.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.215 -0.928 . . . . 0.0 110.397 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -130.09 132.19 46.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.942 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 20.1 mt -104.74 119.54 39.25 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.355 -0.84 . . . . 0.0 110.369 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 2.0 mp -121.17 134.71 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.503 -0.748 . . . . 0.0 109.907 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.431 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 37.2 t80 -141.49 154.53 45.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.548 -0.72 . . . . 0.0 110.007 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.431 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.1 25.56 0.18 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.539 -0.725 . . . . 0.0 111.513 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.34 -4.93 75.14 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.777 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.77 142.84 42.21 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.04 -1.271 . . . . 0.0 110.47 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.71 138.4 38.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.351 -0.843 . . . . 0.0 109.779 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.445 ' HB3' HG12 ' B' ' 23' ' ' ILE . 40.7 mt -84.3 148.4 26.69 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.304 -0.872 . . . . 0.0 109.998 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -93.51 125.95 38.4 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.327 -0.858 . . . . 0.0 110.394 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -48.54 -32.49 8.08 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.362 -0.836 . . . . 0.0 110.984 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.69 -1.85 90.58 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 31.9 mmt-85 -99.57 157.88 16.14 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.066 -1.255 . . . . 0.0 110.29 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.556 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.5 p -102.55 162.22 13.09 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 93.7 mt -53.37 -45.38 69.17 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.279 -0.888 . . . . 0.0 110.649 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.87 -36.7 70.38 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.085 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.63 -27.69 66.56 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.187 -0.946 . . . . 0.0 110.361 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.43 ' CG ' HD22 ' B' ' 50' ' ' LEU . 36.9 m-85 -101.09 27.59 5.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.348 -0.845 . . . . 0.0 109.931 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 50.88 28.03 3.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.464 -0.773 . . . . 0.0 110.716 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.463 HD13 HG21 ' B' ' 61' ' ' ILE . 85.9 mt -81.43 112.04 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.349 -0.845 . . . . 0.0 109.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.63 173.02 6.49 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.38 -0.825 . . . . 0.0 110.448 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.8 pttm -46.65 154.16 0.33 Allowed 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.492 0.663 . . . . 0.0 111.177 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.4 mt-10 62.58 15.61 8.09 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.749 -0.594 . . . . 0.0 110.805 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 141.57 49.9 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.179 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.8 m -107.61 110.63 22.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.292 -0.88 . . . . 0.0 109.945 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 mt -102.76 161.47 13.71 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.313 -0.867 . . . . 0.0 110.008 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -108.8 131.64 54.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.306 -0.871 . . . . 0.0 109.951 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 61.9 tp -106.98 133.85 51.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.217 -0.927 . . . . 0.0 110.551 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 45.1 t . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.35 -0.844 . . . . 0.0 110.205 179.854 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.215 0.531 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -74.77 -27.5 60.36 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.215 -0.928 . . . . 0.0 109.175 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -43.84 97.88 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.874 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.95 -29.15 69.5 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -77.42 -36.84 52.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.529 -0.732 . . . . 0.0 109.866 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -84.3 -54.77 4.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.399 -0.813 . . . . 0.0 110.499 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.7 mmt -54.44 -43.05 71.25 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.148 -0.97 . . . . 0.0 110.627 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.5 m -69.62 -40.4 76.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.272 -0.892 . . . . 0.0 110.621 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 tp -82.17 -15.96 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.154 -0.966 . . . . 0.0 110.221 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 68' ' ' LYS . 27.5 t -74.77 -42.89 57.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.876 . . . . 0.0 109.791 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -79.25 -27.02 42.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.528 -0.733 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.389 -0.819 . . . . 0.0 110.017 179.899 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.36 0.6 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.553 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.3 pt-20 -68.52 -31.68 71.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.521 -0.737 . . . . 0.0 109.196 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.4 mt-10 -85.57 -40.04 16.72 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.25 -44.73 94.32 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -67.35 -34.18 76.78 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.553 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -66.38 -34.86 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.938 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.73 -46.0 90.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.514 -0.741 . . . . 0.0 110.238 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -40.19 29.87 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.367 -0.833 . . . . 0.0 109.949 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.91 79.21 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.349 -0.844 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 tpp -83.88 -24.39 30.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.361 -0.837 . . . . 0.0 110.097 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.298 -0.876 . . . . 0.0 110.228 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.333 0.587 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -98.2 147.6 24.44 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.136 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 pt -137.63 157.72 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.334 -0.854 . . . . 0.0 110.076 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.41 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 80.5 m-85 -111.94 143.08 43.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.588 -0.695 . . . . 0.0 110.663 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 95.7 t -127.83 119.74 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.49 -0.756 . . . . 0.0 109.455 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -100.08 136.75 39.5 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.409 -0.807 . . . . 0.0 110.743 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 73.4 p -96.17 171.13 8.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.437 -0.789 . . . . 0.0 110.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.82 -10.49 9.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.397 -0.814 . . . . 0.0 111.24 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.5 p -95.55 -18.49 20.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.933 -1.105 . . . . 0.0 110.631 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.99 7.4 25.23 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -84.61 129.87 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.083 -1.245 . . . . 0.0 109.811 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.5 m -113.14 126.1 55.07 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.232 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.4 mt -109.23 136.21 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.432 -0.792 . . . . 0.0 110.489 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.41 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 19.2 m -102.41 119.78 39.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.457 -0.777 . . . . 0.0 109.409 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.3 mt -123.51 166.85 14.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -106.52 114.31 28.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.804 . . . . 0.0 109.48 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 33.8 m -140.52 169.34 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 110.951 -179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.61 165.12 13.72 Favored Pre-proline 0 N--CA 1.488 1.474 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -71.67 -24.73 21.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.466 1.245 . . . . 0.0 110.375 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.45 -5.67 59.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 110.531 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -71.24 143.48 50.4 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.265 -0.897 . . . . 0.0 110.721 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.534 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.4 p -83.3 159.52 21.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.588 -0.695 . . . . 0.0 110.391 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.415 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.5 mm -59.64 -36.33 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 109.647 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.83 -35.91 77.73 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 109.424 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -70.29 -33.15 71.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.538 -0.726 . . . . 0.0 109.393 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.1 t -70.15 -39.74 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.172 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -62.86 -43.49 98.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.475 -0.766 . . . . 0.0 109.166 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.35 -32.98 72.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.509 -0.744 . . . . 0.0 109.309 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -68.28 -39.36 82.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.479 -0.763 . . . . 0.0 109.473 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.26 -38.69 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.369 -0.832 . . . . 0.0 109.09 179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.5 OUTLIER -60.53 -50.67 72.64 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.491 179.108 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.19 -26.7 63.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.404 -0.81 . . . . 0.0 110.33 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.9 mmtm -83.85 -40.91 18.08 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.287 -0.883 . . . . 0.0 110.801 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -108.08 -55.57 2.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.244 -0.91 . . . . 0.0 110.449 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.36 18.59 1.82 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.407 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 18.3 mt -91.31 143.52 28.4 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.071 -1.252 . . . . 0.0 109.69 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.416 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.1 Cg_endo -68.0 133.84 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 O-C-N 123.65 1.342 . . . . 0.0 110.387 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.91 -26.48 83.19 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.65 1.342 . . . . 0.0 110.756 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.0 64.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.325 -0.86 . . . . 0.0 110.061 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.416 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 23.1 mt-30 -101.23 -0.9 35.01 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.37 -0.831 . . . . 0.0 110.629 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -94.17 140.39 29.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.163 -0.96 . . . . 0.0 110.243 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -130.08 130.43 44.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.457 -0.777 . . . . 0.0 109.956 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 23.1 mt -104.59 116.91 32.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.404 -0.81 . . . . 0.0 110.441 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -121.16 134.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.493 -0.754 . . . . 0.0 109.862 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.425 ' CD2' HD23 ' B' ' 67' ' ' LEU . 57.5 t80 -140.8 152.5 45.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.469 -0.77 . . . . 0.0 109.941 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.18 27.76 0.35 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.492 -0.755 . . . . 0.0 111.25 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.03 1.64 80.09 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -110.79 137.27 48.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.044 -1.268 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -78.6 135.72 37.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.358 -0.838 . . . . 0.0 109.9 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.436 HD21 ' CE2' ' B' ' 59' ' ' TYR . 51.3 mt -83.83 138.4 33.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.384 -0.822 . . . . 0.0 110.123 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -93.64 131.02 39.34 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 110.422 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.415 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 64.3 m-20 -48.34 -27.6 2.65 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.484 -0.76 . . . . 0.0 111.059 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -7.98 86.47 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.2 mmt-85 -99.36 155.87 17.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.007 -1.29 . . . . 0.0 110.442 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.534 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.9 p -102.51 163.47 12.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.419 -0.8 . . . . 0.0 110.185 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 98.0 mt -53.49 -44.48 69.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.338 -0.851 . . . . 0.0 110.635 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 60.0 p -56.94 -36.85 70.73 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.333 -0.854 . . . . 0.0 110.986 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.52 -27.68 66.4 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.173 -0.955 . . . . 0.0 110.257 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.436 ' CE2' HD21 ' B' ' 50' ' ' LEU . 58.2 m-85 -100.95 27.74 5.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -0.809 . . . . 0.0 109.803 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 m120 50.74 28.33 3.54 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.544 -0.723 . . . . 0.0 110.673 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.454 HG21 HD11 ' B' ' 61' ' ' ILE . 88.5 mt -81.56 108.64 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.403 -0.811 . . . . 0.0 109.96 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.65 173.35 6.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.358 -0.839 . . . . 0.0 110.197 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -46.6 152.71 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.462 -0.774 . . . . 0.0 110.958 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 62.67 16.49 8.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.593 -0.692 . . . . 0.0 110.555 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.58 144.97 49.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.259 -0.901 . . . . 0.0 110.117 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.9 m -107.54 107.9 18.95 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.856 . . . . 0.0 109.919 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.425 HD23 ' CD2' ' B' ' 45' ' ' PHE . 4.3 mt -102.39 160.62 14.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.116 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -108.83 134.49 51.45 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.293 -0.88 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.8 tp -107.21 133.73 51.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.246 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.443 -0.786 . . . . 0.0 110.293 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 121.21 0.529 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -74.34 -29.07 61.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.19 -0.944 . . . . 0.0 109.086 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.41 96.9 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.54 -0.864 . . . . 0.0 108.928 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 17.1 mt -64.73 -28.85 69.87 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.11 -47.54 28.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.522 -0.736 . . . . 0.0 109.842 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 -53.55 7.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.33 -0.856 . . . . 0.0 110.527 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -51.98 -39.6 59.59 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.177 -0.952 . . . . 0.0 110.714 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 34.3 m -69.2 -43.33 74.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.17 -12.65 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.136 -0.978 . . . . 0.0 110.332 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.53 -41.71 45.74 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.79 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -84.28 -23.02 30.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.416 -0.803 . . . . 0.0 110.249 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 . . . . . 0 N--CA 1.493 1.686 0 O-C-N 121.344 -0.848 . . . . 0.0 110.422 -179.895 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.6 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.354 0.597 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.565 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.5 pt-20 -67.61 -30.99 70.72 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.558 -0.713 . . . . 0.0 109.126 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.412 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 65.6 mt-10 -85.31 -40.67 16.3 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.75 -42.16 99.54 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -70.47 -35.62 73.41 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.565 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.33 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.23 96.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.484 -0.76 . . . . 0.0 109.624 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -74.05 -51.82 14.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.495 -0.753 . . . . 0.0 110.147 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.92 -37.65 80.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.453 -0.779 . . . . 0.0 110.358 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 tpt -81.57 -20.13 40.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.103 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.088 179.85 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.455 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.313 0.578 . . . . 0.0 110.349 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -119.08 137.9 53.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.512 -0.742 . . . . 0.0 109.508 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 40.1 pt -137.66 157.97 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -0.967 . . . . 0.0 110.626 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -111.91 146.85 37.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.604 -0.685 . . . . 0.0 110.364 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 66.3 t -127.78 116.55 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 109.598 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.0 136.85 39.29 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.545 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.7 p -96.02 168.3 10.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.444 -0.785 . . . . 0.0 110.063 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt -61.8 -8.84 5.34 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.315 -0.866 . . . . 0.0 111.29 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 47.7 p -95.43 -19.74 19.64 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.079 -1.013 . . . . 0.0 110.597 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.31 6.23 22.24 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -84.66 129.7 34.8 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.093 -1.239 . . . . 0.0 109.968 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.6 m -113.21 128.73 56.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.084 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 38.4 mt -109.28 141.19 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.504 -0.748 . . . . 0.0 110.406 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 27.6 m -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.366 -0.834 . . . . 0.0 109.176 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.414 ' CD2' ' CE ' ' B' ' 33' ' ' LYS . 35.0 mt -123.42 154.35 39.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.987 . . . . 0.0 111.137 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -106.32 114.98 29.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.443 -0.786 . . . . 0.0 109.034 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.455 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.4 m -140.01 176.76 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 111.039 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -113.19 166.87 10.22 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.88 -25.73 19.62 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 O-C-N 123.493 1.26 . . . . 0.0 110.192 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.82 -1.9 57.03 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.171 -0.956 . . . . 0.0 110.552 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -71.19 140.57 50.54 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.123 -0.986 . . . . 0.0 110.567 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.9 p -83.62 159.2 21.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 110.763 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.438 HG21 HD13 ' B' ' 23' ' ' ILE . 44.1 mm -59.71 -40.57 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.42 -0.8 . . . . 0.0 109.621 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -56.85 -34.58 67.95 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 109.579 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -70.59 -33.6 71.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.514 -0.741 . . . . 0.0 109.329 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 82.0 t -69.91 -40.22 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.415 -0.803 . . . . 0.0 109.186 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -62.86 -41.32 99.32 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.419 -0.801 . . . . 0.0 109.083 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.77 74.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.537 -0.727 . . . . 0.0 109.297 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -68.07 -40.5 82.71 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.535 -0.728 . . . . 0.0 109.555 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.402 HD11 HG21 ' B' ' 30' ' ' ILE . 36.8 mt -66.78 -37.34 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.312 -0.868 . . . . 0.0 109.115 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.55 -47.71 84.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.418 -0.801 . . . . 0.0 109.254 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.44 -31.67 67.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.508 -0.745 . . . . 0.0 110.613 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.414 ' CE ' ' CD2' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -83.42 -36.96 23.84 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.293 -0.879 . . . . 0.0 111.262 -179.312 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -108.11 -55.86 2.32 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.106 -0.996 . . . . 0.0 110.55 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 125.88 15.37 2.9 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 90.6 mt -91.25 142.95 27.63 Favored Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.154 -1.203 . . . . 0.0 109.749 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.488 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.6 Cg_endo -68.22 134.79 32.43 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.638 1.336 . . . . 0.0 110.622 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.91 -25.64 81.72 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 O-C-N 123.695 1.366 . . . . 0.0 111.012 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.68 -22.01 64.4 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 109.902 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.488 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.2 mp0 -101.01 -4.25 27.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.454 -0.779 . . . . 0.0 110.513 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -94.26 142.5 27.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.07 130.99 45.59 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.421 -0.799 . . . . 0.0 109.725 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 24.5 mt -104.64 118.72 37.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.244 -0.91 . . . . 0.0 110.448 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.402 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 1.9 mp -121.32 135.37 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.405 -0.81 . . . . 0.0 109.723 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.423 ' CD2' ' HB1' ' B' ' 46' ' ' ALA . 78.9 t80 -140.72 150.49 43.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.453 -0.779 . . . . 0.0 110.053 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.423 ' HB1' ' CD2' ' B' ' 45' ' ' PHE . . . 45.28 28.01 0.4 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.482 -0.761 . . . . 0.0 111.253 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.77 1.97 84.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 136.65 49.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.084 -1.245 . . . . 0.0 110.178 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -78.41 135.17 37.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.831 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.437 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 49.1 mt -83.79 140.72 31.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.296 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.58 131.27 39.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.346 -0.846 . . . . 0.0 110.418 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.42 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 76.7 m-20 -48.3 -32.43 7.34 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.438 -0.789 . . . . 0.0 111.051 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.07 -2.69 90.6 Favored Glycine 0 N--CA 1.493 2.492 0 C-N-CA 120.132 -1.032 . . . . 0.0 110.599 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.419 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.8 mmt85 -99.47 153.34 19.1 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.272 . . . . 0.0 110.445 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 82.6 p -102.2 164.63 11.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.451 -0.781 . . . . 0.0 110.174 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 mt -53.49 -44.82 69.35 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.28 -0.887 . . . . 0.0 110.743 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 42.3 t -56.62 -35.55 68.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.371 -0.831 . . . . 0.0 111.02 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -59.71 -28.98 67.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.296 -0.878 . . . . 0.0 110.407 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 64.3 m-85 -100.94 24.57 9.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.332 -0.855 . . . . 0.0 110.228 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 50.64 30.76 5.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.489 -0.757 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 86.1 mt -81.4 114.37 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.409 -0.807 . . . . 0.0 109.926 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -105.77 171.13 7.5 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.372 -0.83 . . . . 0.0 110.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.1 OUTLIER -46.62 155.11 0.26 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.548 -0.72 . . . . 0.0 111.128 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 63.38 13.11 6.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.702 -0.624 . . . . 0.0 111.003 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.9 141.38 49.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 58.7 m -107.4 115.08 29.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.321 -0.862 . . . . 0.0 109.942 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 mt -102.44 161.13 13.95 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -0.856 . . . . 0.0 110.378 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -108.76 136.79 47.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.312 -0.868 . . . . 0.0 109.806 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.9 tt -107.31 135.96 47.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.176 -0.952 . . . . 0.0 110.466 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.758 . . . . 0.0 110.048 179.854 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 t0 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.265 0.555 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -74.96 -30.53 61.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.186 -0.947 . . . . 0.0 109.026 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -48.87 79.88 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.564 -0.855 . . . . 0.0 108.819 179.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.12 -29.89 68.92 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 tt -76.23 -35.33 59.06 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.497 0.665 . . . . 0.0 109.563 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 1.3 mttt -81.22 -58.0 3.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.427 -0.795 . . . . 0.0 110.289 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 mtt -51.0 -37.3 44.25 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.363 -0.836 . . . . 0.0 110.642 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.2 m -70.02 -44.47 69.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 110.261 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.5 tp -83.59 -11.67 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.208 -0.933 . . . . 0.0 110.437 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 3.4 m -77.33 -44.68 28.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.207 -0.933 . . . . 0.0 109.711 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.28 -24.29 37.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.523 -0.736 . . . . 0.0 110.019 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.402 ' OG1' ' HB2' ' A' ' 91' ' ' GLU . 69.4 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.374 0.606 . . . . 0.0 110.166 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.596 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.15 -34.64 78.86 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.421 -0.799 . . . . 0.0 109.345 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -85.45 -40.19 16.68 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.6 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.402 ' HB2' ' OG1' ' A' ' 88' ' ' THR . 0.3 OUTLIER -65.11 -42.51 93.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 108.528 179.109 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -70.02 -34.01 72.73 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.596 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.68 -35.69 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.58 -45.52 75.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.585 -0.697 . . . . 0.0 109.551 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -67.08 -32.68 74.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.84 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.57 -34.64 35.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 110.064 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.8 mmt -83.89 -26.28 29.53 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.907 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.421 -0.799 . . . . 0.0 110.199 179.947 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.266 0.555 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -97.79 146.46 25.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.498 -0.751 . . . . 0.0 109.93 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.8 pt -137.56 159.03 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.34 -0.85 . . . . 0.0 110.269 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -111.93 142.25 44.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.527 -0.733 . . . . 0.0 110.545 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -127.53 117.91 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.399 -0.813 . . . . 0.0 109.602 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.4 mttm -100.2 130.5 46.34 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.411 -0.806 . . . . 0.0 110.599 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 61.2 p -96.01 175.26 6.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.001 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 12.7 mt -61.72 -11.31 11.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.251 -0.906 . . . . 0.0 111.039 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 62.9 p -95.72 13.82 25.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.962 -1.086 . . . . 0.0 110.791 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.64 7.84 70.36 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 21.6 tttm -84.83 130.05 34.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.985 -1.303 . . . . 0.0 109.919 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 41.7 m -113.33 125.58 54.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.359 -0.838 . . . . 0.0 110.245 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.28 136.23 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.414 -0.804 . . . . 0.0 110.417 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.4 m -102.19 120.83 41.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.301 -0.875 . . . . 0.0 109.448 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.9 mt -123.64 168.84 12.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.129 -0.982 . . . . 0.0 110.919 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -106.27 113.71 27.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.472 -0.767 . . . . 0.0 109.492 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 32.3 m -140.68 167.22 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.279 -0.888 . . . . 0.0 110.958 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.69 167.24 9.49 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.535 -0.728 . . . . 0.0 109.06 178.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.94 -26.75 18.3 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.449 1.236 . . . . 0.0 110.39 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.5 -3.15 58.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.183 -0.948 . . . . 0.0 110.523 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.07 141.92 50.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.0 110.47 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.2 p -83.26 158.04 22.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.57 -0.706 . . . . 0.0 110.345 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.425 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 44.5 mm -59.71 -36.41 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.349 -0.844 . . . . 0.0 109.494 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.25 -35.38 75.37 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.23 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -31.79 68.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.461 -0.775 . . . . 0.0 109.19 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -70.11 -41.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.493 -0.754 . . . . 0.0 109.089 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 38.1 mttt -62.93 -42.87 99.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.476 -0.765 . . . . 0.0 109.34 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.24 -33.84 74.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.518 -0.739 . . . . 0.0 109.426 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -68.3 -39.29 82.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.506 -0.746 . . . . 0.0 109.558 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.5 mt -67.12 -38.96 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 119.669 -0.812 . . . . 0.0 109.18 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.65 -50.66 72.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.416 -0.802 . . . . 0.0 109.588 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.11 -25.89 61.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.375 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -84.01 -41.94 16.73 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.169 -0.957 . . . . 0.0 110.722 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -107.99 -54.51 2.49 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.16 -0.962 . . . . 0.0 110.502 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.45 21.45 1.81 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.436 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 15.2 mt -91.45 145.2 30.89 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.131 -1.217 . . . . 0.0 109.797 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.436 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 39.8 Cg_endo -67.28 131.51 25.17 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.586 1.308 . . . . 0.0 110.4 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.73 -24.59 79.16 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.676 1.356 . . . . 0.0 110.741 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.74 -25.11 64.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 109.636 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -101.28 9.78 41.37 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.574 -0.703 . . . . 0.0 110.209 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.25 137.04 33.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.206 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.04 123.48 30.6 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.351 -0.843 . . . . 0.0 110.1 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 25.0 mt -104.52 115.26 30.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.383 -0.823 . . . . 0.0 110.236 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.412 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 1.9 mp -121.12 137.01 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.515 -0.74 . . . . 0.0 109.727 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -140.65 145.65 36.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.43 -0.794 . . . . 0.0 109.82 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.41 29.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.504 -0.747 . . . . 0.0 111.062 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.3 6.43 87.8 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -111.09 131.6 54.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.051 -1.264 . . . . 0.0 110.238 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -78.59 131.68 36.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.257 -0.902 . . . . 0.0 109.615 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.434 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 26.1 mt -83.95 139.01 32.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.904 . . . . 0.0 110.351 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.71 132.43 38.08 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.319 -0.863 . . . . 0.0 110.775 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.425 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 7.8 m-20 -48.42 -28.38 3.22 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.519 -0.738 . . . . 0.0 111.104 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.95 -6.69 88.12 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.59 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -99.38 156.27 17.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.072 -1.252 . . . . 0.0 110.45 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.8 p -102.12 162.24 13.07 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.822 . . . . 0.0 110.249 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 86.8 mt -53.42 -44.72 69.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.315 -0.865 . . . . 0.0 110.667 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.9 t -56.65 -34.5 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.322 -0.861 . . . . 0.0 110.991 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -59.63 -28.06 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.228 -0.92 . . . . 0.0 110.403 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 73.9 m-85 -101.18 27.42 6.15 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.382 -0.824 . . . . 0.0 109.958 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 m120 50.94 31.85 6.72 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.46 -0.775 . . . . 0.0 110.757 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.485 HG21 HD12 ' B' ' 61' ' ' ILE . 88.6 mt -81.7 113.8 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.049 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -105.72 167.93 9.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.367 -0.833 . . . . 0.0 110.122 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 12.2 pttp -46.46 153.09 0.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.496 -0.752 . . . . 0.0 110.918 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.4 OUTLIER 62.48 16.8 8.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.595 -0.691 . . . . 0.0 110.511 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.51 146.18 48.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 110.302 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -107.67 109.17 20.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.391 -0.818 . . . . 0.0 109.957 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -102.56 162.78 12.65 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.293 -0.88 . . . . 0.0 110.075 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -108.75 131.2 55.17 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.215 -0.928 . . . . 0.0 109.906 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 57.6 tp -107.17 128.09 54.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 0.0 110.385 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.493 1.677 0 O-C-N 121.428 -0.795 . . . . 0.0 110.007 179.843 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t0 . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.291 0.567 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -76.11 -29.77 58.0 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.296 -0.877 . . . . 0.0 109.131 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.47 96.8 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.796 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -29.2 70.26 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -40.21 55.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.466 -0.771 . . . . 0.0 109.87 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' SER . 10.8 mmtp -81.79 -55.28 4.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.387 -0.821 . . . . 0.0 110.516 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 tpp -52.37 -42.42 63.95 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.152 -0.968 . . . . 0.0 110.604 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 84.7 m -68.02 -42.86 80.01 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.311 -0.868 . . . . 0.0 110.559 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.3 tp -82.5 -12.99 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.231 -0.918 . . . . 0.0 110.413 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 68' ' ' LYS . 11.9 m -76.08 -39.43 55.37 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.338 -0.851 . . . . 0.0 109.749 179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -84.35 -27.09 27.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.416 -0.802 . . . . 0.0 110.079 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.941 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.6 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.282 0.563 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.581 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.3 pt-20 -71.52 -32.36 68.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.457 -0.777 . . . . 0.0 109.207 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -85.24 -38.18 19.21 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.272 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -43.21 89.19 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -68.07 -35.23 77.86 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.81 -37.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.46 -33.35 74.66 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.496 -0.752 . . . . 0.0 109.823 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -75.78 -31.66 59.58 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.36 -32.44 29.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.457 -0.777 . . . . 0.0 110.167 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.54 -29.77 27.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.36 -0.837 . . . . 0.0 109.689 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.373 -0.829 . . . . 0.0 109.915 179.854 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.4 ttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.253 0.549 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 140.68 29.48 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.33 -0.856 . . . . 0.0 109.725 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.41 158.06 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.235 -0.915 . . . . 0.0 110.32 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.81 143.85 42.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.71 -0.619 . . . . 0.0 110.681 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 64.1 t -127.99 124.58 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 109.517 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -99.88 134.11 43.27 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.423 -0.798 . . . . 0.0 110.291 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 40.3 p -95.47 172.89 7.8 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.331 -0.856 . . . . 0.0 110.302 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.446 ' N ' ' CD2' ' B' ' 8' ' ' LEU . 4.6 mm? -61.26 -13.54 19.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.486 -0.759 . . . . 0.0 111.034 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.5 p -95.72 -5.77 41.36 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.026 -1.046 . . . . 0.0 110.997 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.99 9.43 57.21 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.62 136.53 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.259 . . . . 0.0 109.779 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 31.0 m -113.07 127.32 56.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.229 -0.919 . . . . 0.0 110.373 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.29 137.27 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 23.3 m -102.09 120.68 40.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.3 mt -123.48 158.59 30.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.095 -1.003 . . . . 0.0 110.918 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -106.29 113.8 27.54 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 109.385 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.0 m -140.29 177.4 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.266 -0.896 . . . . 0.0 110.938 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -113.03 164.61 15.07 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.89 -27.27 17.87 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.523 1.275 . . . . 0.0 110.282 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.63 -1.34 55.9 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.885 . . . . 0.0 110.735 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.99 143.87 50.67 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.073 -1.017 . . . . 0.0 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 81.1 p -83.4 159.15 21.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.491 -0.756 . . . . 0.0 110.606 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.453 HG23 HD12 ' B' ' 23' ' ' ILE . 44.7 mm -59.62 -37.45 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.381 -0.824 . . . . 0.0 109.461 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -60.22 -34.67 73.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.422 -0.799 . . . . 0.0 109.358 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.47 -33.77 71.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.0 109.264 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.1 t -70.04 -40.06 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.454 -0.779 . . . . 0.0 109.26 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -62.9 -42.62 99.85 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.462 -0.774 . . . . 0.0 109.206 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.56 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.481 -0.762 . . . . 0.0 109.368 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -39.8 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.567 -0.708 . . . . 0.0 109.535 179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.8 mt -67.01 -37.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.96 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 50.0 tt0 -60.77 -50.57 72.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.377 -0.827 . . . . 0.0 109.374 178.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -58.07 -27.72 63.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 110.517 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -83.93 -39.04 20.29 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.307 -0.871 . . . . 0.0 110.778 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -108.07 -56.85 2.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 127.23 19.19 1.96 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.079 -1.209 . . . . 0.0 110.079 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.401 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 25.2 mt -91.43 144.03 29.06 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.092 -1.24 . . . . 0.0 109.93 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.6 Cg_endo -68.28 132.3 25.5 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.714 1.376 . . . . 0.0 110.459 179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.67 -25.12 80.28 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.736 1.387 . . . . 0.0 110.816 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -26.15 64.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.418 -0.801 . . . . 0.0 109.84 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.433 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.6 mm100 -101.24 2.5 39.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.446 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -94.21 139.65 30.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.09 129.05 43.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.38 -0.825 . . . . 0.0 110.15 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.4 mt -104.71 118.57 36.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.412 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 2.0 mp -121.09 135.09 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.436 -0.79 . . . . 0.0 109.992 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -140.73 149.5 42.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.606 -0.684 . . . . 0.0 109.543 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 28.46 0.52 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.423 -0.798 . . . . 0.0 111.088 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.36 2.1 78.14 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -111.04 136.79 49.52 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.093 -1.239 . . . . 0.0 110.215 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -78.4 138.99 38.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.227 -0.921 . . . . 0.0 109.824 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.444 HD23 ' CD2' ' B' ' 59' ' ' TYR . 47.9 mt -83.68 140.8 31.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.374 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.56 128.15 39.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.409 -0.807 . . . . 0.0 110.429 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.437 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 75.4 m-20 -48.35 -29.88 4.39 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.472 -0.767 . . . . 0.0 111.127 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.92 -5.19 89.58 Favored Glycine 0 N--CA 1.493 2.498 0 C-N-CA 120.121 -1.038 . . . . 0.0 110.622 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt-85 -99.34 155.97 17.24 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.983 -1.304 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.7 p -102.46 165.4 11.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.393 -0.817 . . . . 0.0 110.232 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 64.9 mt -53.78 -47.62 70.57 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.779 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 29.1 t -56.75 -35.95 69.22 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.333 -0.854 . . . . 0.0 111.18 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -59.47 -27.38 66.06 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.107 -0.995 . . . . 0.0 110.236 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.444 ' CD2' HD23 ' B' ' 50' ' ' LEU . 34.2 m-85 -101.37 27.96 5.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.394 -0.816 . . . . 0.0 109.919 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 50.72 26.51 2.56 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.513 -0.742 . . . . 0.0 110.829 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.457 HD12 HG22 ' B' ' 61' ' ' ILE . 96.4 mt -81.53 109.56 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.274 -0.891 . . . . 0.0 109.906 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -105.68 173.38 6.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.379 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.7 151.72 0.56 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 111.088 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 35.0 mt-10 63.0 16.33 9.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.768 -0.582 . . . . 0.0 110.616 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.4 144.61 49.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 12.6 m -107.4 108.46 19.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 109.821 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 mt -102.31 160.29 14.66 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.318 -0.864 . . . . 0.0 110.041 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -108.95 132.89 53.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.278 -0.889 . . . . 0.0 110.151 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 61.8 tp -107.21 130.94 54.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.861 . . . . 0.0 109.95 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 16.6 t . . . . . 0 N--CA 1.492 1.655 0 O-C-N 121.452 -0.78 . . . . 0.0 110.155 -179.935 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.238 0.542 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -76.23 -28.24 57.1 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.205 -0.934 . . . . 0.0 109.221 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.7 99.62 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.584 -0.846 . . . . 0.0 108.882 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.85 -29.66 69.63 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 tt -76.58 -37.53 56.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.578 -0.701 . . . . 0.0 109.871 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 72' ' ' SER . 21.5 mmtm -83.87 -55.24 4.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 110.361 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.9 tpt -52.86 -42.75 65.52 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.7 m -69.96 -41.85 73.95 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.8 tp -83.77 -12.08 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 110.59 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 68' ' ' LYS . 83.5 p -78.78 -45.42 21.06 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.175 -0.953 . . . . 0.0 109.801 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -82.97 -18.78 38.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.499 -0.751 . . . . 0.0 110.267 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.184 -0.947 . . . . 0.0 110.677 -179.742 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.491 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.6 p . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.382 0.611 . . . . 0.0 110.433 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.552 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 pt-20 -70.78 -30.04 66.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.514 -0.741 . . . . 0.0 109.149 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.415 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 6.9 mt-10 -83.44 -38.37 21.97 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.491 ' HB2' ' N ' ' A' ' 88' ' ' THR . 69.5 mm-40 -65.37 -43.69 89.98 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -66.95 -35.27 79.6 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.552 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.99 -36.95 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.77 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.96 81.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.79 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.18 -54.52 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.072 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.3 -34.15 74.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.5 ttp -80.91 -25.28 37.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.799 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.427 -0.796 . . . . 0.0 109.997 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.431 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.3 ttp . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.21 0.528 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.69 140.55 29.41 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.405 -0.81 . . . . 0.0 109.708 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 42.6 pt -137.33 158.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.19 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -111.67 145.88 38.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.557 -0.714 . . . . 0.0 110.427 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.7 t -127.89 122.55 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.452 -0.78 . . . . 0.0 109.95 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.38 128.51 46.43 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.515 -0.741 . . . . 0.0 110.257 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 66.8 p -95.74 177.51 5.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.371 -0.83 . . . . 0.0 110.473 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.12 -16.98 50.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.44 -0.788 . . . . 0.0 110.841 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.6 p -96.04 21.71 8.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.065 -1.022 . . . . 0.0 110.661 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.6 15.96 58.13 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.432 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.9 ttpm? -84.73 131.58 34.55 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.128 -1.219 . . . . 0.0 109.821 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 22.5 m -112.84 125.21 54.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.65 141.52 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.399 -0.813 . . . . 0.0 110.258 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 7.4 m -101.94 120.06 39.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.295 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 mp -123.24 159.64 28.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.211 -0.931 . . . . 0.0 110.978 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.62 114.96 29.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 109.317 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.431 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.7 m -140.15 172.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.241 -0.912 . . . . 0.0 110.883 -179.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -112.86 165.1 13.82 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.54 -28.29 17.79 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.587 1.309 . . . . 0.0 110.384 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -84.66 -2.14 57.09 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.199 -0.938 . . . . 0.0 110.649 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.14 141.67 50.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.22 -0.925 . . . . 0.0 110.538 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.0 p -83.36 159.77 21.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 110.378 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.468 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.4 mm -59.93 -35.46 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.377 -0.827 . . . . 0.0 109.773 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -60.83 -38.04 84.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.828 . . . . 0.0 109.587 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -69.95 -31.51 69.29 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 109.195 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.2 t -70.1 -39.8 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.0 109.086 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.05 -42.16 99.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.565 -0.709 . . . . 0.0 109.144 179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.27 -34.74 75.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.5 -0.75 . . . . 0.0 109.243 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -68.13 -35.48 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.328 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.2 mt -67.71 -42.04 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.447 -0.783 . . . . 0.0 109.279 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 11.4 tt0 -60.11 -49.58 77.09 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.805 . . . . 0.0 109.445 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.35 -25.81 62.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.379 -0.826 . . . . 0.0 110.393 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -84.04 -43.97 14.59 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.262 -0.898 . . . . 0.0 110.873 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -107.99 -50.29 3.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.219 -0.926 . . . . 0.0 110.631 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.55 18.23 3.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 110.074 -1.211 . . . . 0.0 110.074 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.433 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 91.0 mt -91.28 145.32 31.26 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.133 -1.216 . . . . 0.0 109.735 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.433 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 39.2 Cg_endo -67.75 133.93 31.02 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.579 1.304 . . . . 0.0 110.505 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.71 -25.94 81.97 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.781 1.411 . . . . 0.0 110.746 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.7 -21.98 64.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.785 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.424 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.2 mt-30 -101.18 0.59 37.86 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.463 -0.773 . . . . 0.0 110.337 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -94.25 138.51 32.18 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.892 . . . . 0.0 110.472 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -130.06 128.53 42.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.715 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.418 ' N ' ' CD2' ' B' ' 43' ' ' LEU . 4.5 mm? -104.44 114.94 29.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.367 -0.833 . . . . 0.0 110.37 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.406 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.0 mp -121.23 134.07 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.561 -0.712 . . . . 0.0 109.811 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -140.92 148.6 40.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.421 -0.799 . . . . 0.0 109.95 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.49 28.57 0.51 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 111.134 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.58 2.16 84.38 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.03 130.99 55.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.117 -1.225 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -78.52 136.68 37.62 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.318 -0.864 . . . . 0.0 109.814 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.427 ' HB3' HG13 ' B' ' 23' ' ' ILE . 39.4 mt -83.99 141.09 31.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.302 -0.874 . . . . 0.0 110.303 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -93.79 133.12 37.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.357 -0.84 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.468 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 15.8 m-20 -48.17 -30.62 4.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.514 -0.741 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -5.51 89.21 Favored Glycine 0 N--CA 1.494 2.548 0 C-N-CA 120.159 -1.019 . . . . 0.0 110.732 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.422 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.1 mmt-85 -99.28 155.12 17.67 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.053 -1.263 . . . . 0.0 110.477 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.5 p -102.16 163.97 11.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.46 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 83.5 mt -53.69 -45.44 70.37 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.352 -0.843 . . . . 0.0 110.877 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 18.2 t -56.58 -34.2 66.93 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.408 -0.807 . . . . 0.0 110.956 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -59.7 -27.79 66.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.427 ' CD2' HD21 ' B' ' 50' ' ' LEU . 76.7 m-85 -101.19 26.0 7.58 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -0.844 . . . . 0.0 110.166 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 50.68 30.4 4.9 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.436 -0.79 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.43 HD11 HG22 ' B' ' 61' ' ' ILE . 94.7 mt -81.41 113.64 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.215 -0.928 . . . . 0.0 109.84 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -105.68 170.44 7.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.366 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.1 pttt -46.71 152.46 0.48 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.5 -0.75 . . . . 0.0 111.11 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.4 mm-40 63.31 15.03 8.34 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.688 -0.632 . . . . 0.0 110.696 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.74 144.47 49.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.147 -0.97 . . . . 0.0 110.073 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -107.44 113.18 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.81 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -102.39 162.45 12.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.4 -0.813 . . . . 0.0 110.125 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -108.74 132.59 53.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 109.665 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 42.7 tp -106.89 131.25 54.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 110.314 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 45.6 t . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.417 -0.802 . . . . 0.0 110.289 -179.902 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.1 t0 . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 121.257 0.551 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -78.14 -32.9 50.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.169 -0.957 . . . . 0.0 109.471 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.49 -37.06 82.28 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.402 -0.919 . . . . 0.0 108.736 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.9 mt -69.55 -31.44 69.63 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.14 -43.89 55.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.583 -0.698 . . . . 0.0 109.576 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.9 -53.42 8.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.497 -0.752 . . . . 0.0 110.094 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.0 ttt -49.36 -37.34 24.47 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.256 -0.903 . . . . 0.0 110.743 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.5 p -71.09 -39.59 72.05 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.334 -0.854 . . . . 0.0 110.526 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.1 tp -83.93 -16.82 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.256 -0.903 . . . . 0.0 110.289 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.87 -41.19 60.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.946 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -86.63 -19.24 29.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.46 -0.775 . . . . 0.0 110.28 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.28 -0.887 . . . . 0.0 110.338 179.946 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.473 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 81.4 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.321 0.581 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.562 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.4 mt-10 -75.82 -29.26 58.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.414 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 2.6 mp0 -85.48 -36.53 20.5 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.473 ' HB2' ' N ' ' A' ' 88' ' ' THR . 63.1 mm-40 -66.26 -44.35 83.87 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.562 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -70.64 -33.69 54.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.737 -0.602 . . . . 0.0 109.401 178.92 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.19 91.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.432 -0.793 . . . . 0.0 110.051 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -37.22 21.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 109.967 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.17 -37.88 81.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.271 -0.893 . . . . 0.0 110.185 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.2 ttt -81.51 -22.56 37.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.948 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 110.094 -179.952 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.452 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 44.6 ttp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -92.65 139.42 30.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.359 -0.838 . . . . 0.0 109.79 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.6 158.18 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 110.348 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -112.0 144.36 41.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.567 -0.708 . . . . 0.0 110.779 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.79 118.23 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.488 -0.757 . . . . 0.0 109.588 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -100.25 129.9 46.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.422 -0.798 . . . . 0.0 110.578 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 40.0 p -96.13 174.98 6.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.377 -0.827 . . . . 0.0 110.136 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.47 -13.6 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.335 -0.853 . . . . 0.0 111.056 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.2 p -95.72 18.13 13.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.099 -1.0 . . . . 0.0 110.698 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.28 11.62 61.94 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -84.96 127.76 34.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.055 -1.262 . . . . 0.0 109.895 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.9 m -112.94 125.15 54.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.264 -0.898 . . . . 0.0 110.272 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 31.6 mt -109.51 138.65 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.464 -0.773 . . . . 0.0 110.492 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.4 m -102.59 121.21 41.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.774 . . . . 0.0 109.452 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.1 mt -123.75 161.41 25.23 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.127 -0.983 . . . . 0.0 111.163 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -106.31 114.59 28.8 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.536 -0.727 . . . . 0.0 109.27 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.9 m -140.2 175.52 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.282 -0.886 . . . . 0.0 110.85 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -113.36 165.88 12.38 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.91 -27.37 17.7 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 O-C-N 123.453 1.238 . . . . 0.0 110.234 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.68 -1.57 56.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.144 -0.972 . . . . 0.0 110.518 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -71.26 143.22 50.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.213 -0.929 . . . . 0.0 110.477 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 75.9 p -83.24 158.24 22.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.597 -0.689 . . . . 0.0 110.396 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.449 HG13 ' HB3' ' B' ' 50' ' ' LEU . 42.8 mm -59.71 -37.58 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 109.413 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -60.0 -34.59 73.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.427 -0.796 . . . . 0.0 109.148 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -70.33 -31.86 69.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.546 -0.721 . . . . 0.0 109.198 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.93 -39.77 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -62.85 -41.73 99.47 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.43 -33.2 73.31 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.551 -0.718 . . . . 0.0 109.229 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.2 mttp -68.43 -38.56 81.32 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.991 -0.684 . . . . 0.0 109.504 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 12.5 mt -67.41 -40.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.313 -0.867 . . . . 0.0 109.33 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -60.44 -49.36 77.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.299 -0.876 . . . . 0.0 109.574 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -58.05 -28.2 64.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.504 -0.747 . . . . 0.0 110.46 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.8 mmtt -83.61 -43.11 15.99 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.387 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -108.13 -116.98 0.27 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.36 -0.838 . . . . 0.0 109.842 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.67 22.1 0.21 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 83.0 mt -91.94 141.44 25.39 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.149 -1.206 . . . . 0.0 109.982 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.555 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.5 Cg_endo -71.71 139.16 33.27 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.637 1.336 . . . . 0.0 110.217 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.62 -27.16 84.34 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 O-C-N 123.675 1.355 . . . . 0.0 111.075 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -68.77 -23.6 64.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.287 -0.883 . . . . 0.0 109.904 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.555 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 5.8 mp0 -100.98 2.79 40.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.418 -0.801 . . . . 0.0 110.661 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -94.17 136.51 34.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.178 -0.951 . . . . 0.0 110.5 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -130.21 128.42 41.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.476 -0.765 . . . . 0.0 109.789 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.2 mt -104.54 118.51 36.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.303 -0.873 . . . . 0.0 110.336 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.416 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 1.9 mp -121.23 133.67 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.533 -0.729 . . . . 0.0 109.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.417 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 31.0 t80 -140.77 152.44 45.23 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.367 -0.833 . . . . 0.0 109.995 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.417 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.14 27.43 0.31 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.459 -0.776 . . . . 0.0 111.118 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.73 1.16 83.07 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -110.95 138.05 47.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -1.21 . . . . 0.0 110.226 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -78.7 136.01 37.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.333 -0.854 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.449 ' HB3' HG13 ' B' ' 23' ' ' ILE . 57.5 mt -83.63 139.55 32.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.188 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 129.06 40.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.396 -0.815 . . . . 0.0 110.404 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.439 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 11.8 m-20 -48.4 -27.3 2.53 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.418 -0.801 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.61 86.97 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.118 -1.039 . . . . 0.0 110.564 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.414 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 21.0 mmt180 -99.23 155.8 17.3 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.988 -1.301 . . . . 0.0 110.428 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.3 p -102.2 165.22 11.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.385 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 87.9 mt -53.59 -44.6 69.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.358 -0.839 . . . . 0.0 110.673 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.2 t -56.61 -36.49 69.48 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.451 -0.781 . . . . 0.0 110.865 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.89 -27.71 66.94 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.236 -0.915 . . . . 0.0 110.418 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.416 ' CD2' HD22 ' B' ' 50' ' ' LEU . 71.2 m-85 -101.12 25.28 8.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.352 -0.842 . . . . 0.0 110.209 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 30.1 m120 50.66 30.94 5.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.378 -0.826 . . . . 0.0 110.554 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.436 HD13 HG23 ' B' ' 61' ' ' ILE . 89.1 mt -81.38 112.54 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.856 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -105.65 169.35 8.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.366 -0.834 . . . . 0.0 110.191 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 7.5 pttm -46.51 152.7 0.43 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.582 -0.699 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 61.1 mm-40 63.08 15.42 8.47 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.768 -0.583 . . . . 0.0 110.719 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.92 49.84 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.191 -0.943 . . . . 0.0 110.078 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 17.7 m -107.62 110.74 22.69 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.989 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 mt -102.46 164.29 11.75 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.355 -0.84 . . . . 0.0 110.169 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 67.1 m80 -108.93 132.76 53.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 57.0 tp -107.3 130.34 54.78 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.23 -0.919 . . . . 0.0 110.478 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 N--CA 1.492 1.672 0 O-C-N 121.403 -0.811 . . . . 0.0 110.01 179.866 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.7 t70 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 121.203 0.525 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.0 -29.04 60.76 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.193 -0.942 . . . . 0.0 109.145 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.55 96.43 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.597 -0.841 . . . . 0.0 108.855 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tp -64.78 -28.52 69.63 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 tt -74.69 -47.71 30.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.52 -0.737 . . . . 0.0 109.875 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.01 -52.61 8.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.484 -0.76 . . . . 0.0 110.617 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.4 ttp -51.89 -38.86 57.76 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.226 -0.921 . . . . 0.0 110.65 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.5 m -70.31 -42.28 72.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.325 -0.86 . . . . 0.0 110.357 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.7 tp -81.53 -15.62 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.191 -0.943 . . . . 0.0 110.081 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -74.16 -39.89 62.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.394 -0.816 . . . . 0.0 109.672 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -80.88 -29.3 35.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.476 -0.765 . . . . 0.0 109.862 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.41 -0.806 . . . . 0.0 110.105 179.823 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.1 p . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.262 0.553 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.599 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.9 pt-20 -65.06 -32.77 74.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.548 -0.72 . . . . 0.0 109.356 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -85.32 -41.2 15.72 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 120.074 -0.65 . . . . 0.0 109.362 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -63.95 -39.89 95.18 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -71.8 -35.13 69.89 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.599 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -63.19 -41.1 91.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.846 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.11 71.64 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -82.97 -36.06 25.42 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.737 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.98 -35.55 66.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.445 -0.784 . . . . 0.0 110.037 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.1 ppp? -79.22 -25.65 42.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.457 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 . . . . . 0 N--CA 1.488 1.43 0 O-C-N 121.451 -0.781 . . . . 0.0 109.849 179.821 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.334 0.588 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -97.47 146.38 25.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -0.783 . . . . 0.0 110.035 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.1 pt -137.53 157.4 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 110.025 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.404 ' CE1' ' OG1' ' B' ' 14' ' ' THR . 81.1 m-85 -111.68 143.59 42.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.686 -0.634 . . . . 0.0 110.638 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -127.78 118.56 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.42 -0.8 . . . . 0.0 109.405 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -100.1 138.05 37.71 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.365 -0.835 . . . . 0.0 110.574 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 42.5 p -96.14 170.13 9.48 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.455 -0.778 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.7 -10.58 8.96 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.407 -0.808 . . . . 0.0 111.181 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.3 p -95.29 -24.38 16.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.961 -1.087 . . . . 0.0 110.507 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.6 7.31 10.9 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -84.64 128.56 34.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.057 -1.26 . . . . 0.0 109.943 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.4 m -113.16 125.29 54.18 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 110.198 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.19 135.67 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.41 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.404 ' OG1' ' CE1' ' B' ' 4' ' ' PHE . 7.1 m -102.43 119.26 38.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 109.532 179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.3 mt -123.58 166.97 14.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.107 -0.996 . . . . 0.0 110.859 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -106.5 114.63 28.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 109.382 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 33.0 m -140.39 169.53 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.991 -179.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -112.46 166.18 11.52 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.512 -0.742 . . . . 0.0 109.101 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.48 -26.44 20.16 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.499 1.263 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.63 -2.4 57.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.133 -0.979 . . . . 0.0 110.474 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -71.28 141.35 50.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.157 -0.964 . . . . 0.0 110.396 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 44.0 p -83.43 157.51 22.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.542 -0.724 . . . . 0.0 110.385 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.423 HG21 HD12 ' B' ' 23' ' ' ILE . 39.9 mm -59.55 -31.18 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.259 -0.901 . . . . 0.0 109.529 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.93 -36.91 85.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.486 -0.759 . . . . 0.0 109.377 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -32.89 70.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.486 -0.759 . . . . 0.0 109.206 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.02 -39.86 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.434 -0.791 . . . . 0.0 109.126 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -63.02 -42.39 99.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.49 -0.756 . . . . 0.0 109.147 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.01 74.72 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.538 -0.726 . . . . 0.0 109.392 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -68.31 -39.74 81.93 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.459 -0.776 . . . . 0.0 109.616 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.3 mt -67.2 -38.8 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.373 -0.829 . . . . 0.0 109.248 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -52.41 65.24 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.473 -0.767 . . . . 0.0 109.768 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -58.09 -26.69 62.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.412 -0.805 . . . . 0.0 110.575 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.1 mmtm -83.97 -39.01 20.25 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.25 -0.906 . . . . 0.0 110.986 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -107.97 -54.89 2.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.208 -0.933 . . . . 0.0 110.501 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.75 14.28 2.34 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 23.0 mt -91.28 143.35 28.17 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.007 -1.29 . . . . 0.0 109.756 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.523 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.3 Cg_endo -69.88 137.06 34.23 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 123.665 1.35 . . . . 0.0 110.501 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.77 -27.04 84.16 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 O-C-N 123.728 1.383 . . . . 0.0 111.197 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.65 -22.62 64.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.262 -0.899 . . . . 0.0 109.88 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.523 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.5 mp0 -101.12 -1.87 32.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.417 -0.802 . . . . 0.0 110.518 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.01 140.95 29.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.181 -0.949 . . . . 0.0 110.492 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.13 127.62 40.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 109.853 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.2 mt -104.58 118.17 35.92 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.93 . . . . 0.0 110.223 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 1.9 mp -121.2 137.95 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.493 -0.755 . . . . 0.0 109.821 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.412 ' CD2' HD23 ' B' ' 67' ' ' LEU . 47.8 t80 -140.79 147.83 39.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.438 -0.789 . . . . 0.0 109.795 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 29.05 0.54 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.407 -0.808 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.13 6.01 87.41 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 110.621 -0.991 . . . . 0.0 110.621 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mtmm -110.96 134.44 52.58 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.054 -1.262 . . . . 0.0 110.293 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.38 131.07 36.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.866 . . . . 0.0 109.542 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.432 HD21 ' CE2' ' B' ' 59' ' ' TYR . 38.7 mt -83.65 135.55 34.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -93.5 132.88 37.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.396 -0.815 . . . . 0.0 110.578 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.404 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.2 m-20 -48.38 -26.29 2.0 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.588 -0.695 . . . . 0.0 111.165 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.8 -7.81 86.8 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.5 mmt-85 -99.54 154.23 18.41 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.266 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 23.3 p -102.4 164.18 11.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.374 -0.828 . . . . 0.0 110.174 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 92.8 mt -53.53 -43.35 68.29 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.266 -0.896 . . . . 0.0 110.671 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 13.2 t -56.81 -36.24 69.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.402 -0.811 . . . . 0.0 110.971 -179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.62 -27.75 66.59 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.231 -0.918 . . . . 0.0 110.398 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.432 ' CE2' HD21 ' B' ' 50' ' ' LEU . 80.3 m-85 -100.92 25.83 7.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.228 -0.92 . . . . 0.0 110.068 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 50.65 30.31 4.8 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.444 HG23 HD12 ' B' ' 61' ' ' ILE . 90.9 mt -81.35 113.07 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.402 -0.811 . . . . 0.0 109.934 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -105.58 171.82 7.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.452 -0.78 . . . . 0.0 110.179 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 pttp -46.51 152.39 0.46 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.487 -0.758 . . . . 0.0 111.0 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 5.1 mt-10 62.74 16.35 8.9 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.693 -0.63 . . . . 0.0 110.639 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.05 49.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.041 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.3 m -107.62 111.1 23.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.344 -0.848 . . . . 0.0 109.977 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.412 HD23 ' CD2' ' B' ' 45' ' ' PHE . 1.3 mt -102.55 164.92 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.325 -0.86 . . . . 0.0 110.13 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -108.79 132.37 54.05 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.301 -0.874 . . . . 0.0 110.186 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 59.6 tp -107.3 131.4 54.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.346 -0.846 . . . . 0.0 110.255 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 39.5 t . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.901 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 121.168 0.508 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.84 -32.08 57.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.252 -0.905 . . . . 0.0 109.29 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.28 82.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.49 -0.884 . . . . 0.0 108.784 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -70.51 -29.43 65.93 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.0 tt -76.88 -40.89 45.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.55 -0.719 . . . . 0.0 109.874 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.0 tptt -82.97 -50.17 8.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.403 -0.811 . . . . 0.0 110.529 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.5 tpt -57.46 -40.59 78.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.6 m -69.72 -40.57 76.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.271 -0.893 . . . . 0.0 110.414 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.3 tp -83.66 -16.5 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 O-C-N 121.215 -0.928 . . . . 0.0 110.288 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -73.91 -42.03 61.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.252 -0.905 . . . . 0.0 109.782 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -81.51 -26.12 35.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.44 -0.787 . . . . 0.0 110.026 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.444 -0.785 . . . . 0.0 110.237 179.887 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.332 0.586 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.567 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 pt-20 -66.1 -32.42 73.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.617 -0.677 . . . . 0.0 109.317 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.401 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.2 mp0 -85.3 -40.36 16.65 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.26 -41.43 99.04 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -71.14 -35.4 71.68 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.567 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.9 -38.7 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -34.42 78.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.455 -0.778 . . . . 0.0 109.736 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -80.0 -44.23 20.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.417 -0.802 . . . . 0.0 110.16 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.32 -31.7 67.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.294 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 56.2 tpp -82.54 -20.81 35.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.365 -0.835 . . . . 0.0 109.981 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 110.096 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.153 0.501 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -87.65 140.42 29.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.371 -0.831 . . . . 0.0 109.882 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.1 pt -137.64 159.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -0.859 . . . . 0.0 110.614 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.406 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 81.1 m-85 -111.96 142.19 44.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.647 -0.658 . . . . 0.0 110.551 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 94.3 t -128.17 125.08 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.431 -0.793 . . . . 0.0 109.723 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.23 130.12 46.32 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.439 -0.788 . . . . 0.0 110.514 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 19.7 p -95.79 177.66 5.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.424 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -16.19 42.18 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.431 -0.793 . . . . 0.0 111.007 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.9 19.59 11.24 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.038 -1.039 . . . . 0.0 110.693 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.9 12.8 58.17 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.92 133.37 34.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.073 -1.251 . . . . 0.0 109.825 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.3 m -113.21 125.59 54.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 16.2 mt -109.13 136.67 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.384 -0.823 . . . . 0.0 110.466 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.406 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 11.4 m -102.19 118.52 37.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.412 -0.805 . . . . 0.0 109.222 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.0 mt -123.27 165.29 17.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.137 -0.977 . . . . 0.0 110.883 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -106.35 117.12 33.21 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.381 -0.825 . . . . 0.0 109.743 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.424 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.4 m -140.42 176.21 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.331 -0.856 . . . . 0.0 110.712 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -113.06 163.86 16.98 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.571 -0.706 . . . . 0.0 109.137 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.06 -27.17 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.507 1.267 . . . . 0.0 110.332 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.3 p -84.71 -3.11 58.4 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.099 -1.0 . . . . 0.0 110.704 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -71.38 140.08 50.02 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.097 -1.002 . . . . 0.0 110.687 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.43 161.37 21.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.551 -0.718 . . . . 0.0 110.371 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.429 ' N ' HD13 ' B' ' 23' ' ' ILE . 1.7 mp -59.14 -34.03 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.733 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -60.61 -37.76 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -0.941 . . . . 0.0 109.339 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -31.24 68.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.445 -0.784 . . . . 0.0 109.425 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 88.3 t -70.28 -42.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.411 -0.806 . . . . 0.0 109.38 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.8 mttt -63.0 -41.77 99.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.474 -0.766 . . . . 0.0 109.251 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -35.22 76.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.446 -0.784 . . . . 0.0 109.282 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -68.3 -38.18 81.37 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 109.661 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.6 mt -67.3 -40.31 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.103 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.52 -49.63 76.79 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.449 -0.782 . . . . 0.0 109.462 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.12 -26.53 62.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.326 -0.859 . . . . 0.0 110.314 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -83.91 -41.24 17.62 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.406 -0.809 . . . . 0.0 110.739 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.06 -56.1 2.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.264 -0.898 . . . . 0.0 110.417 -179.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.57 19.57 1.65 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.402 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 22.6 mt -91.31 143.89 28.95 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.061 -1.258 . . . . 0.0 109.644 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.492 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.3 Cg_endo -68.2 133.64 29.18 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.614 1.323 . . . . 0.0 110.482 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.77 -23.81 77.35 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.79 1.416 . . . . 0.0 110.991 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.82 -23.77 64.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.252 -0.905 . . . . 0.0 109.762 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.492 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.38 0.63 40.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.428 -0.795 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -94.22 137.61 33.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.198 -0.939 . . . . 0.0 110.407 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -130.12 132.01 45.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 39.2 mt -104.79 118.03 35.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.398 -0.814 . . . . 0.0 110.673 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.404 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.0 mp -121.33 133.41 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.5 -0.75 . . . . 0.0 109.797 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 11.4 t80 -141.25 155.54 46.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.397 -0.814 . . . . 0.0 109.977 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.426 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 44.7 24.75 0.11 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.424 -0.797 . . . . 0.0 111.558 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.8 -8.86 67.56 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.119 -1.039 . . . . 0.0 110.851 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' B' ' 45' ' ' PHE . 9.2 ptmt -110.69 142.14 43.0 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.809 -1.406 . . . . 0.0 110.484 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.4 137.26 37.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.346 -0.846 . . . . 0.0 109.908 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.44 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 24.9 mt -83.79 148.84 26.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.333 -0.854 . . . . 0.0 110.346 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -93.48 130.25 39.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.298 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -48.56 -28.13 3.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.494 -0.754 . . . . 0.0 111.079 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 -3.05 90.66 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 12.2 mmt180 -99.49 155.99 17.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.126 -1.22 . . . . 0.0 110.346 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.55 163.19 12.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.388 -0.82 . . . . 0.0 110.182 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 85.9 mt -53.24 -45.74 68.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.281 -0.887 . . . . 0.0 110.574 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.5 t -56.93 -35.89 69.58 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.415 -0.803 . . . . 0.0 110.838 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -59.6 -29.43 67.97 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.307 -0.871 . . . . 0.0 110.44 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.44 ' CE2' ' HB3' ' B' ' 50' ' ' LEU . 41.8 m-85 -101.07 28.48 5.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.352 -0.843 . . . . 0.0 109.977 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 26.2 m-20 50.7 28.23 3.45 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.512 -0.743 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.481 HD13 HG21 ' B' ' 61' ' ' ILE . 88.0 mt -81.47 110.19 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.394 -0.816 . . . . 0.0 109.876 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -105.62 172.48 6.77 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.282 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.3 pttt -46.62 151.97 0.52 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.477 -0.765 . . . . 0.0 110.995 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 4.0 mm-40 62.76 15.94 8.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.783 -0.573 . . . . 0.0 110.623 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.61 145.23 49.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.929 . . . . 0.0 110.162 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 39.8 m -107.76 109.78 21.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.842 . . . . 0.0 110.082 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -102.29 161.58 13.58 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.345 -0.847 . . . . 0.0 110.043 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -108.64 132.01 54.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 109.909 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 32.9 tp -107.05 136.09 47.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.318 -0.864 . . . . 0.0 110.165 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.862 . . . . 0.0 109.953 179.969 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.25 0.548 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.31 -30.13 57.6 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.222 -0.924 . . . . 0.0 109.119 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.883 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mp -64.99 -29.06 69.96 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 tt -76.44 -37.57 56.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 0.0 109.769 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -83.51 -55.84 4.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.297 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.2 tpt -52.12 -45.35 64.91 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.203 -0.936 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.0 m -66.22 -42.64 88.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.343 -0.848 . . . . 0.0 110.474 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.5 tp -82.78 -6.39 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 0.0 110.368 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -82.26 -46.68 13.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 110.044 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -83.74 -20.88 32.6 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.362 -0.836 . . . . 0.0 110.433 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.465 -179.812 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 74.7 p . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.419 0.628 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.532 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.0 pt-20 -68.61 -28.85 67.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.582 -0.699 . . . . 0.0 109.279 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.403 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 33.6 mt-10 -85.61 -40.68 15.97 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 179.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -64.85 -43.71 92.13 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -66.74 -34.12 77.13 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.532 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.41 -35.75 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -38.44 91.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.486 -0.759 . . . . 0.0 109.485 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.68 -42.54 64.17 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.94 92.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.46 -0.775 . . . . 0.0 110.018 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 34.6 mmm -75.53 -22.41 57.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.419 -0.801 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.482 0 O-C-N 121.545 -0.722 . . . . 0.0 109.902 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.204 0.526 . . . . 0.0 110.35 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.67 134.42 47.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.409 -0.807 . . . . 0.0 109.555 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 13.2 pt -136.9 155.6 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 109.943 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.408 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 83.3 m-85 -111.64 144.28 41.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.559 -0.713 . . . . 0.0 111.04 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.2 t -127.82 117.77 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.476 -0.765 . . . . 0.0 109.262 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.29 133.95 43.95 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.507 -0.746 . . . . 0.0 110.894 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 72.1 p -96.4 172.08 8.17 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 39.7 mt -61.7 -11.58 12.57 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.405 -0.809 . . . . 0.0 111.017 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.4 p -95.61 0.22 52.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.015 -1.053 . . . . 0.0 110.909 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.46 9.11 67.26 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.5 tttp -84.61 126.09 33.04 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.089 -1.242 . . . . 0.0 109.859 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.0 m -112.97 123.39 50.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.303 -0.873 . . . . 0.0 110.284 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 17.9 mt -109.23 136.58 44.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.534 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.408 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 17.5 m -102.25 119.47 38.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.432 -0.792 . . . . 0.0 109.377 179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.69 162.42 23.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.149 -0.969 . . . . 0.0 111.023 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -106.32 118.89 37.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.542 -0.724 . . . . 0.0 109.262 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.454 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.4 m -140.4 178.65 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.157 -0.964 . . . . 0.0 111.333 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -113.57 159.8 34.1 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -73.69 -24.95 15.25 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 O-C-N 123.403 1.212 . . . . 0.0 110.041 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.8 -4.62 59.15 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.241 -0.912 . . . . 0.0 110.328 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -71.14 144.99 50.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.176 -0.952 . . . . 0.0 110.573 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 71.8 p -83.25 158.24 22.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.484 -0.76 . . . . 0.0 110.329 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.455 HG23 HD12 ' B' ' 23' ' ' ILE . 46.0 mm -59.75 -32.31 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.841 . . . . 0.0 109.505 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.73 -36.96 84.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.421 -0.799 . . . . 0.0 109.251 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.3 -32.01 69.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.506 -0.746 . . . . 0.0 109.162 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.4 t -70.13 -41.18 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.466 -0.771 . . . . 0.0 109.223 179.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -62.96 -41.64 99.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 109.151 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.57 -34.4 75.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.744 . . . . 0.0 109.422 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -68.03 -39.01 83.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.459 179.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.0 mt -66.94 -38.73 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.315 -0.866 . . . . 0.0 109.098 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -49.56 77.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.448 -0.782 . . . . 0.0 109.457 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.24 -27.21 63.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.516 -0.74 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.82 -40.94 18.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.252 -0.905 . . . . 0.0 110.875 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -108.04 -55.78 2.32 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.253 -0.904 . . . . 0.0 110.419 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.08 18.72 1.66 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 80.8 mt -91.38 143.12 27.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.13 -1.217 . . . . 0.0 109.944 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.428 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.8 Cg_endo -69.98 133.73 25.85 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 O-C-N 123.542 1.285 . . . . 0.0 110.492 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.81 -26.69 83.52 Favored 'Trans proline' 0 C--N 1.313 -1.321 0 O-C-N 123.618 1.325 . . . . 0.0 110.949 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.76 -24.25 64.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.357 -0.839 . . . . 0.0 109.968 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.428 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 28.8 mm-40 -101.43 0.59 37.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.288 -0.882 . . . . 0.0 110.441 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -94.38 140.25 30.05 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.14 -0.975 . . . . 0.0 110.447 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -130.14 128.43 41.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.453 -0.779 . . . . 0.0 109.797 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 32.5 mt -104.68 118.97 37.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.322 -0.861 . . . . 0.0 110.522 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 1.6 mp -121.36 135.98 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.506 -0.746 . . . . 0.0 109.922 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -140.83 151.2 44.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.468 -0.77 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.37 28.27 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.511 -0.743 . . . . 0.0 111.195 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.54 1.44 76.64 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.01 137.67 48.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.07 -1.253 . . . . 0.0 110.175 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -78.33 139.13 38.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.258 -0.902 . . . . 0.0 109.998 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.457 HD22 ' CG ' ' B' ' 59' ' ' TYR . 55.1 mt -83.89 143.45 29.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.333 -0.855 . . . . 0.0 110.348 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.62 126.52 38.83 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.505 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.8 p30 -48.69 -29.73 4.75 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.444 -0.785 . . . . 0.0 111.132 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -6.15 88.69 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -99.47 158.6 15.62 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.025 -1.279 . . . . 0.0 110.388 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.5 p -102.06 164.12 11.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.438 -0.789 . . . . 0.0 110.288 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 92.9 mt -53.86 -45.7 71.04 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.341 -0.849 . . . . 0.0 110.751 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 55.4 p -56.58 -34.17 66.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.303 -0.873 . . . . 0.0 111.198 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -59.52 -27.65 66.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.094 -1.004 . . . . 0.0 110.374 -179.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.457 ' CG ' HD22 ' B' ' 50' ' ' LEU . 70.5 m-85 -101.12 27.02 6.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.857 . . . . 0.0 109.983 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.92 32.35 7.28 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.407 HD12 HG22 ' B' ' 61' ' ' ILE . 97.7 mt -81.56 108.91 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.286 -0.884 . . . . 0.0 109.869 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -105.64 173.67 6.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.374 -0.829 . . . . 0.0 110.346 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.4 ptmt -46.62 152.1 0.5 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.59 -0.694 . . . . 0.0 111.17 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.3 mm-40 62.84 15.47 8.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.792 -0.568 . . . . 0.0 110.841 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.64 139.17 49.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -107.37 111.05 23.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.927 . . . . 0.0 110.03 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mp -102.29 164.0 11.92 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.28 -0.888 . . . . 0.0 110.022 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -108.88 130.7 55.43 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 109.996 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 tp -107.19 133.67 51.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.883 . . . . 0.0 110.286 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 27.7 t . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.405 -0.809 . . . . 0.0 109.958 179.805 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.27 0.557 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -74.6 -28.13 60.77 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.183 -0.948 . . . . 0.0 109.161 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.93 97.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.931 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.29 -29.2 69.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.1 tt -75.17 -43.46 52.1 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.482 -0.762 . . . . 0.0 109.891 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.423 -0.798 . . . . 0.0 110.482 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -39.87 61.48 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.144 -0.972 . . . . 0.0 110.671 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.7 m -69.43 -41.31 76.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.299 -0.876 . . . . 0.0 110.453 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.2 tp -82.18 -16.4 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.114 -0.991 . . . . 0.0 110.134 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -74.61 -33.74 62.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.3 -0.875 . . . . 0.0 109.748 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -27.71 23.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.469 -0.77 . . . . 0.0 109.93 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.338 -0.851 . . . . 0.0 110.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.1 p . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.336 0.588 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.575 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.9 pt-20 -67.14 -31.29 71.63 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.543 -0.723 . . . . 0.0 109.175 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.419 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.9 OUTLIER -85.48 -40.75 16.03 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -42.56 99.75 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -69.8 -35.92 75.24 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 178.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.575 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.76 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.798 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.67 72.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.541 -0.724 . . . . 0.0 109.802 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.21 -52.7 7.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.481 -0.762 . . . . 0.0 110.09 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.0 -33.09 74.94 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.4 -0.812 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.2 ttm -80.2 -21.52 42.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 109.824 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.422 -0.799 . . . . 0.0 110.071 179.878 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.26 0.552 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -97.24 145.38 26.12 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.502 -0.749 . . . . 0.0 109.903 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 12.7 pt -137.65 159.47 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.344 -0.848 . . . . 0.0 110.17 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -111.85 142.82 43.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.582 -0.699 . . . . 0.0 110.754 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -127.76 118.16 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.476 -0.765 . . . . 0.0 109.503 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -100.25 135.19 42.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 110.607 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -96.04 170.04 9.56 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.454 -0.779 . . . . 0.0 110.189 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 8.3 mt -61.82 -9.27 6.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.459 -0.776 . . . . 0.0 111.203 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.9 p -95.27 -13.34 24.94 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.081 -1.012 . . . . 0.0 110.564 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 6.16 40.26 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.238 -1.145 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -84.61 128.56 34.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.113 -1.228 . . . . 0.0 110.049 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.8 m -113.23 125.21 54.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.303 -0.873 . . . . 0.0 110.08 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.4 mt -109.12 135.13 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.439 -0.788 . . . . 0.0 110.522 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.1 m -102.43 118.0 35.93 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.516 -0.74 . . . . 0.0 109.26 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -123.38 166.45 15.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.156 -0.965 . . . . 0.0 110.821 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.5 115.11 29.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.441 -0.787 . . . . 0.0 109.528 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 m -140.51 170.26 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.282 -0.886 . . . . 0.0 110.823 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -112.7 164.62 14.95 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.586 -0.696 . . . . 0.0 109.185 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -70.94 -25.51 23.04 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.569 1.3 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.36 -3.93 58.58 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.444 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -71.31 143.6 50.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.559 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.6 p -83.21 156.66 23.06 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.547 -0.72 . . . . 0.0 110.446 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.454 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 31.4 mm -59.67 -34.77 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.383 -0.823 . . . . 0.0 109.616 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.74 -36.92 82.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.34 -0.85 . . . . 0.0 109.33 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.2 -32.21 70.02 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.353 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.36 -39.2 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.451 -0.78 . . . . 0.0 109.049 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -63.14 -43.78 97.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.103 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.05 73.13 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.463 -0.773 . . . . 0.0 109.469 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.6 mttm -68.07 -40.26 82.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.495 -0.753 . . . . 0.0 109.543 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 18.0 mt -67.1 -37.14 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.586 -0.845 . . . . 0.0 109.03 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -60.83 -52.72 63.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.474 -0.767 . . . . 0.0 109.644 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -27.46 63.7 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.712 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -84.0 -39.93 19.07 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.198 -0.939 . . . . 0.0 111.037 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -108.15 -54.19 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.278 -0.889 . . . . 0.0 110.512 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.81 16.64 2.19 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.264 -1.135 . . . . 0.0 110.264 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 93.5 mt -91.2 143.51 28.48 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.077 -1.249 . . . . 0.0 109.778 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.443 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.1 Cg_endo -69.49 133.88 27.17 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.66 1.347 . . . . 0.0 110.556 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.83 -26.43 83.05 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.741 1.39 . . . . 0.0 110.81 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.78 -25.65 64.81 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.341 -0.85 . . . . 0.0 109.902 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 58.8 mm-40 -101.26 4.36 41.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.35 -0.844 . . . . 0.0 110.464 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.22 139.32 31.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.238 -0.914 . . . . 0.0 110.468 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -130.17 126.4 37.35 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.473 -0.767 . . . . 0.0 109.783 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 13.7 mt -104.64 117.91 35.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.251 -0.905 . . . . 0.0 110.376 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 2.0 mp -121.35 138.06 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.513 -0.742 . . . . 0.0 109.92 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' B' ' 46' ' ' ALA . 66.8 t80 -140.7 147.88 39.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.567 -0.708 . . . . 0.0 109.753 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.426 ' HB3' ' CD2' ' B' ' 45' ' ' PHE . . . 45.42 28.8 0.51 Allowed 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.416 -0.803 . . . . 0.0 111.189 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.8 3.75 87.69 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.85 133.69 53.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.083 -1.245 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -78.49 134.3 37.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.064 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.452 HD23 ' CE2' ' B' ' 59' ' ' TYR . 39.9 mt -84.27 140.31 31.74 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.385 -0.822 . . . . 0.0 110.28 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -93.67 130.49 39.59 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.406 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.454 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.2 m-20 -48.43 -26.75 2.25 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.433 -0.792 . . . . 0.0 111.202 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.96 -8.05 86.33 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.702 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.459 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.34 159.04 15.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.01 -1.288 . . . . 0.0 110.432 -179.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.1 p -102.08 162.98 12.49 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.396 -0.815 . . . . 0.0 110.182 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 82.0 mt -53.45 -43.98 68.53 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.295 -0.878 . . . . 0.0 110.669 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.9 -34.72 68.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.413 -0.804 . . . . 0.0 111.131 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.5 -26.96 65.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.11 -0.994 . . . . 0.0 110.394 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.459 ' CE2' ' HB3' ' B' ' 54' ' ' ARG . 53.2 m-85 -101.15 26.21 7.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 110.053 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m120 50.63 31.06 5.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.541 -0.724 . . . . 0.0 110.728 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.446 HD13 HG23 ' B' ' 61' ' ' ILE . 88.5 mt -81.41 114.53 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.86 . . . . 0.0 109.784 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -105.55 167.86 9.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.384 -0.823 . . . . 0.0 110.219 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.9 pttt -46.54 153.13 0.39 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.479 -0.763 . . . . 0.0 111.041 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 21.0 mt-10 63.4 14.01 7.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.766 -0.584 . . . . 0.0 110.818 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.83 144.62 49.05 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.157 -0.964 . . . . 0.0 110.225 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.0 m -107.51 110.9 22.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.331 -0.856 . . . . 0.0 109.818 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.7 mt -102.38 165.03 11.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.252 -0.905 . . . . 0.0 110.344 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -108.82 129.53 55.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.358 -0.839 . . . . 0.0 110.125 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -107.34 131.24 54.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.423 -0.798 . . . . 0.0 110.18 179.9 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.5 t0 . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.173 0.511 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.18 -28.89 61.51 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.243 -0.91 . . . . 0.0 109.075 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.47 96.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.939 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.4 tp -65.08 -28.35 69.4 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.45 -48.35 34.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.535 -0.728 . . . . 0.0 109.563 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.63 -52.95 7.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 110.545 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 tpt -51.73 -38.78 56.77 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.232 -0.917 . . . . 0.0 110.824 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.3 m -71.11 -40.65 71.33 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.264 -0.898 . . . . 0.0 110.396 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 tp -83.65 -13.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.973 . . . . 0.0 110.226 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -76.28 -48.43 20.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.293 -0.88 . . . . 0.0 109.784 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -25.41 47.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 110.064 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.831 . . . . 0.0 110.223 -179.964 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 75.4 p . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.364 0.602 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.544 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -67.24 -31.83 72.44 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.477 -0.764 . . . . 0.0 109.248 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.411 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 27.3 mt-10 -85.44 -40.61 16.22 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -63.89 -42.26 97.52 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.1 -35.39 76.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.544 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.31 -36.83 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.87 -29.76 69.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 109.616 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -83.82 -38.51 21.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.466 -0.772 . . . . 0.0 110.057 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -79.57 -28.98 41.12 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.329 -0.857 . . . . 0.0 110.469 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -83.96 -31.83 25.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.3 -0.875 . . . . 0.0 109.73 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.505 -0.747 . . . . 0.0 110.008 179.844 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.43 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.4 ttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.303 0.573 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -112.96 140.19 47.97 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.374 -0.829 . . . . 0.0 109.606 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 43.2 pt -137.72 157.15 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.212 -0.93 . . . . 0.0 110.535 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -111.89 144.89 40.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.598 -0.689 . . . . 0.0 110.546 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 68.4 t -128.13 122.38 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.342 -0.849 . . . . 0.0 109.603 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -100.16 131.98 45.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.689 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.4 p -95.79 175.71 6.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.431 -0.793 . . . . 0.0 109.921 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 22.1 mt -61.57 -12.77 16.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.309 -0.869 . . . . 0.0 111.17 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.2 p -95.73 14.5 22.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.007 -1.058 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.84 8.34 68.1 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -84.79 134.02 34.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.066 -1.256 . . . . 0.0 109.913 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.3 m -113.26 130.28 56.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -0.881 . . . . 0.0 110.318 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 mt -109.15 141.89 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.401 -0.812 . . . . 0.0 110.239 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 8.5 m -101.84 121.94 43.05 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.441 -0.787 . . . . 0.0 109.504 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mt -123.27 156.27 35.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.16 -0.963 . . . . 0.0 110.831 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 113.95 27.79 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.422 -0.798 . . . . 0.0 109.422 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.43 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.2 m -139.9 178.46 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.309 -0.869 . . . . 0.0 110.856 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -113.01 166.14 11.7 Favored Pre-proline 0 N--CA 1.489 1.492 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.27 -28.86 14.81 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.469 1.247 . . . . 0.0 110.277 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.44 -0.68 53.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.63 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -71.21 142.71 50.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.38 159.51 21.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.537 -0.727 . . . . 0.0 110.498 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.437 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 44.1 mm -59.71 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.363 -0.836 . . . . 0.0 109.565 179.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -36.88 74.74 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.385 -0.822 . . . . 0.0 109.425 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -70.06 -31.17 68.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.495 -0.753 . . . . 0.0 109.208 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -70.24 -39.89 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 119.839 -0.745 . . . . 0.0 109.134 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -63.26 -43.05 99.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.502 -0.749 . . . . 0.0 109.178 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.9 76.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.502 -0.749 . . . . 0.0 109.49 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -68.12 -38.32 82.09 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.501 -0.749 . . . . 0.0 109.491 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.19 -39.73 83.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.415 -0.803 . . . . 0.0 109.111 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' B' ' 35' ' ' GLY . 13.9 tt0 -60.61 -47.86 84.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.301 -0.875 . . . . 0.0 109.299 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -58.01 -27.76 63.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.407 -0.808 . . . . 0.0 110.241 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.9 mmtm -84.27 -41.26 17.06 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.399 -0.813 . . . . 0.0 110.874 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -107.76 -55.79 2.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.248 -0.907 . . . . 0.0 110.365 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.8 21.27 1.77 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.414 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 56.8 mt -91.65 144.4 29.44 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.197 -1.178 . . . . 0.0 109.976 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.415 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.1 Cg_endo -68.51 131.83 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.536 1.282 . . . . 0.0 110.622 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.96 -24.61 79.87 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.653 1.344 . . . . 0.0 110.714 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.61 -25.4 64.84 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.829 . . . . 0.0 109.731 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.415 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 4.4 mt-30 -101.33 0.1 36.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.49 -0.756 . . . . 0.0 110.425 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -94.44 137.22 33.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.201 -0.937 . . . . 0.0 110.475 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.22 134.69 47.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.454 -0.779 . . . . 0.0 109.765 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 18.0 mt -104.67 116.59 32.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.217 -0.927 . . . . 0.0 110.333 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.417 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 2.2 mp -121.21 135.14 62.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.463 -0.773 . . . . 0.0 109.831 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -140.69 145.98 37.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.338 -0.851 . . . . 0.0 109.767 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.66 28.93 0.59 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.741 . . . . 0.0 110.932 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.56 5.1 88.02 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -111.03 128.71 55.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.166 -1.197 . . . . 0.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 132.48 37.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 109.589 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.439 ' CD2' ' CG ' ' B' ' 59' ' ' TYR . 48.9 mt -83.74 142.96 30.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.223 -0.923 . . . . 0.0 110.274 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -93.5 133.12 37.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.486 -0.759 . . . . 0.0 110.442 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.437 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 65.9 m-20 -48.54 -28.18 3.22 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.565 -0.709 . . . . 0.0 111.027 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -5.85 88.81 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 120.116 -1.04 . . . . 0.0 110.692 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.43 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 11.2 mmt180 -99.51 153.57 18.92 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.027 -1.278 . . . . 0.0 110.488 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.6 p -102.23 165.63 11.03 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.291 -0.881 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 87.8 mt -53.6 -45.66 70.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.29 -0.881 . . . . 0.0 110.78 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -56.82 -38.39 72.54 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.432 -0.792 . . . . 0.0 110.958 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -59.68 -27.93 66.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.325 -0.86 . . . . 0.0 110.425 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.439 ' CG ' ' CD2' ' B' ' 50' ' ' LEU . 40.8 m-85 -100.98 26.72 6.67 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.954 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 50.69 27.39 2.97 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.569 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.452 HD11 HG23 ' B' ' 61' ' ' ILE . 88.0 mt -81.37 109.46 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.377 -0.827 . . . . 0.0 109.79 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.54 172.11 6.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.426 -0.796 . . . . 0.0 110.164 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.44 152.73 0.42 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.547 -0.721 . . . . 0.0 111.084 -179.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.7 mm-40 63.0 16.55 9.37 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.81 -0.556 . . . . 0.0 110.595 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.63 145.66 48.82 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.3 m -107.91 108.05 19.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 10.3 mt -102.54 157.96 16.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.29 -0.881 . . . . 0.0 110.091 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -108.88 138.52 45.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.254 -0.904 . . . . 0.0 109.995 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 45.9 tp -106.95 133.16 52.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.349 -0.845 . . . . 0.0 110.276 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 110.405 -179.817 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 121.137 0.494 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -75.1 -28.92 60.45 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.246 -0.909 . . . . 0.0 109.145 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.92 97.66 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.685 -0.806 . . . . 0.0 108.869 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -28.62 69.44 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -75.69 -45.78 34.95 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.598 -0.688 . . . . 0.0 109.869 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.1 OUTLIER -80.01 -53.51 6.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.484 -0.76 . . . . 0.0 110.487 -179.851 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.92 -40.37 60.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.139 -0.976 . . . . 0.0 110.643 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.2 m -69.43 -41.17 76.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.259 -0.9 . . . . 0.0 110.423 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.0 tp -85.38 -10.62 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.076 -1.015 . . . . 0.0 110.466 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 30.3 t -80.32 -36.27 34.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.717 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -89.25 -23.87 22.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.54 -0.725 . . . . 0.0 110.067 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.344 -0.847 . . . . 0.0 110.461 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.486 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.7 p . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.3 0.571 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.548 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.9 pt-20 -69.49 -29.45 67.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.511 -0.743 . . . . 0.0 109.365 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.7 OUTLIER -84.7 -38.41 19.77 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.486 ' HB2' ' N ' ' A' ' 88' ' ' THR . 10.0 mm-40 -66.52 -43.77 84.29 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -66.6 -35.39 80.09 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.548 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.8 -35.74 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.703 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.2 -38.84 92.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.622 -0.674 . . . . 0.0 109.402 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -44.89 59.23 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.508 -0.745 . . . . 0.0 109.95 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.77 82.16 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.414 -0.804 . . . . 0.0 110.019 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 20.5 mmt -79.32 -24.64 42.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.31 -0.869 . . . . 0.0 109.628 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 0.0 109.991 179.837 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.446 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.4 ttp . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.241 0.543 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -88.09 140.78 29.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.0 109.717 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 35.3 pt -137.37 157.65 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.257 -0.902 . . . . 0.0 110.259 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.8 144.31 41.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.654 -0.654 . . . . 0.0 110.598 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.3 t -128.16 126.02 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 109.659 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -99.81 138.45 36.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.285 -0.885 . . . . 0.0 110.636 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 74.2 p -95.85 171.56 8.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.479 -0.763 . . . . 0.0 110.481 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.424 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.34 -14.05 24.16 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -0.813 . . . . 0.0 111.164 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.2 p -95.6 -23.6 16.97 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.092 -1.005 . . . . 0.0 110.75 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.59 10.94 8.98 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? -84.57 137.42 33.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.268 . . . . 0.0 109.797 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.0 m -113.12 126.31 55.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.291 -0.881 . . . . 0.0 110.306 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 mt -108.96 136.3 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.411 -0.806 . . . . 0.0 110.255 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.4 m -101.85 121.09 41.45 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 109.319 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mt -123.3 159.37 28.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.192 -0.943 . . . . 0.0 110.858 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -106.35 113.71 27.39 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.183 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.446 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.8 m -140.19 174.34 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.331 -0.856 . . . . 0.0 110.951 -178.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -112.9 165.41 13.19 Favored Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.92 -26.97 18.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.525 1.276 . . . . 0.0 110.326 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.39 -2.63 57.46 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 110.522 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.58 142.28 50.03 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 65.8 p -83.41 160.5 21.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.704 . . . . 0.0 110.485 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.431 HG23 HD13 ' B' ' 23' ' ' ILE . 42.0 mm -59.64 -35.64 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.619 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.86 -35.88 75.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.197 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -32.21 69.53 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.536 -0.728 . . . . 0.0 109.29 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 72.4 t -69.96 -42.84 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.499 -0.751 . . . . 0.0 109.387 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -62.88 -40.69 98.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.466 -0.771 . . . . 0.0 109.324 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -36.46 81.03 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.682 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -68.15 -38.12 81.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 0.0 109.688 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.414 HD13 HG22 ' B' ' 30' ' ' ILE . 11.5 mt -67.02 -39.59 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.374 -0.829 . . . . 0.0 109.119 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.2 tm0? -60.48 -48.89 79.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.429 -0.794 . . . . 0.0 109.422 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.08 -26.55 62.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.787 . . . . 0.0 110.25 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -84.07 -39.97 18.9 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -108.03 -55.97 2.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.316 -0.865 . . . . 0.0 110.622 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.02 15.7 2.29 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.412 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 60.7 mt -91.38 144.62 29.99 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.134 -1.215 . . . . 0.0 109.849 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.462 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -69.77 134.64 28.45 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.546 1.287 . . . . 0.0 110.454 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -61.02 -26.59 83.34 Favored 'Trans proline' 0 C--N 1.312 -1.376 0 O-C-N 123.793 1.417 . . . . 0.0 111.152 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.92 -19.67 64.2 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.26 -0.9 . . . . 0.0 110.228 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.462 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.4 mp0 -100.98 -9.42 21.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 110.753 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -94.35 145.7 24.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.166 -0.959 . . . . 0.0 110.873 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.6 ttt85 -130.18 134.25 47.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.514 -0.742 . . . . 0.0 109.522 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 25.8 mt -104.34 117.54 34.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.423 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.408 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.1 mp -121.2 133.68 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.633 -0.667 . . . . 0.0 109.742 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.419 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 28.4 t80 -140.63 151.44 44.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.454 -0.779 . . . . 0.0 109.902 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.419 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.42 27.41 0.37 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.491 -0.756 . . . . 0.0 111.243 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.81 -0.82 81.16 Favored Glycine 0 N--CA 1.495 2.594 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.605 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.87 136.0 50.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.069 -1.254 . . . . 0.0 110.275 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.5 137.06 37.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.88 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.431 HD21 ' CZ ' ' B' ' 59' ' ' TYR . 39.5 mt -84.1 139.9 32.16 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.0 110.324 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -93.61 134.71 35.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.306 -0.871 . . . . 0.0 110.465 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.411 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.7 p-10 -48.6 -30.89 5.84 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.495 -0.753 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.01 -4.02 90.18 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.405 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 23.6 mmt180 -99.63 153.54 18.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.053 -1.263 . . . . 0.0 110.652 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 78.4 p -102.33 163.42 12.24 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.333 -0.854 . . . . 0.0 110.222 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 71.9 mt -53.52 -43.87 68.68 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.223 -0.923 . . . . 0.0 110.616 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 85.8 p -56.67 -37.33 70.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.389 -0.819 . . . . 0.0 111.051 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.44 -26.46 65.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.185 -0.947 . . . . 0.0 110.354 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.431 ' CZ ' HD21 ' B' ' 50' ' ' LEU . 70.0 m-85 -101.24 25.11 8.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.177 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t30 50.52 29.21 3.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.477 -0.764 . . . . 0.0 110.726 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.416 HG23 HD11 ' B' ' 61' ' ' ILE . 94.1 mt -81.39 112.45 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 109.759 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -105.57 170.77 7.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.373 -0.829 . . . . 0.0 110.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.0 OUTLIER -46.53 151.89 0.51 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.56 -0.713 . . . . 0.0 111.04 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 52.2 mm-40 62.86 16.44 9.11 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.714 -0.616 . . . . 0.0 110.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 147.7 47.22 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.907 . . . . 0.0 110.205 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -107.66 109.22 20.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.374 -0.828 . . . . 0.0 109.878 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt -102.23 158.85 15.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.322 -0.862 . . . . 0.0 110.019 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -108.77 131.98 54.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.86 . . . . 0.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 31.0 tp -107.19 136.08 47.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.35 -0.844 . . . . 0.0 110.009 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 121.271 -0.893 . . . . 0.0 110.222 -179.893 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.46 -178.66 3.43 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.336 -0.852 . . . . 0.0 110.169 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 mp -112.41 25.74 11.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.533 -0.729 . . . . 0.0 109.485 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.87 -40.28 7.7 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt 52.22 83.02 0.06 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.31 -1.112 . . . . 0.0 110.478 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.99 78.44 0.61 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -130.0 -63.48 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.405 -1.056 . . . . 0.0 110.248 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.05 28.68 4.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.374 -0.829 . . . . 0.0 110.222 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.46 -24.84 19.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.446 -0.784 . . . . 0.0 110.186 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -90.37 -28.32 18.77 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.296 -0.878 . . . . 0.0 110.297 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.22 34.01 3.08 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 110.312 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.17 -42.18 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.363 -0.836 . . . . 0.0 110.098 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.38 -24.45 75.0 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.405 HG22 ' N ' ' A' ' 15' ' ' ASP . 35.2 m -125.69 -38.77 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.209 -1.171 . . . . 0.0 110.407 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.435 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.1 OUTLIER 57.44 176.93 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.207 -0.933 . . . . 0.0 109.807 -179.854 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.435 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 42.6 Cg_endo -69.29 -20.99 36.3 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.545 1.287 . . . . 0.0 110.4 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.3 t -72.3 -13.1 61.41 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.322 -0.861 . . . . 0.0 110.388 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.74 -25.65 30.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.176 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.44 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 33.9 p-10 -165.28 116.31 0.87 Allowed Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.338 -0.851 . . . . 0.0 110.383 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.12 -14.75 35.3 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 O-C-N 123.998 1.525 . . . . 0.0 109.875 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.39 -29.83 66.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.438 -0.789 . . . . 0.0 109.123 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.18 -32.09 17.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.604 -0.685 . . . . 0.0 109.285 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.78 -32.48 59.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.0 109.535 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.7 tp -79.91 -37.25 35.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.426 -0.797 . . . . 0.0 109.843 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.17 -36.36 83.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.371 -0.831 . . . . 0.0 109.911 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.75 -21.3 41.21 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.426 -0.796 . . . . 0.0 110.31 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -80.27 -28.0 38.45 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.304 -0.873 . . . . 0.0 109.303 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 83.2 t -81.28 -32.86 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.623 -0.673 . . . . 0.0 109.629 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.19 -41.52 49.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.394 -0.816 . . . . 0.0 110.038 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.0 mmm -66.08 -37.45 85.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.347 -0.846 . . . . 0.0 109.985 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.48 -42.49 92.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.317 -0.864 . . . . 0.0 110.031 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -61.23 -34.03 74.46 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.427 -0.796 . . . . 0.0 110.146 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -72.7 -39.15 67.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.362 -0.836 . . . . 0.0 110.132 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -48.43 78.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.257 -0.902 . . . . 0.0 109.769 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -29.96 66.7 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.434 -0.791 . . . . 0.0 109.754 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -82.95 -38.03 23.32 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.442 -0.786 . . . . 0.0 109.815 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.425 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -62.31 -37.57 86.09 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.442 -0.786 . . . . 0.0 109.946 179.796 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.4 -57.25 3.97 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.491 -0.756 . . . . 0.0 109.5 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.73 -30.56 33.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.483 -0.761 . . . . 0.0 109.304 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -88.07 -33.19 18.39 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.59 -0.694 . . . . 0.0 109.207 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.425 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.1 -46.62 83.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.371 -0.831 . . . . 0.0 109.582 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.9 ptt85 -73.0 -32.67 65.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.414 -0.804 . . . . 0.0 109.8 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -37.17 63.77 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.397 -0.815 . . . . 0.0 109.317 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.82 -28.85 44.5 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.04 -28.17 67.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.585 -0.697 . . . . 0.0 109.675 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -93.65 -27.95 16.27 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.497 -0.752 . . . . 0.0 110.073 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -75.37 -29.08 59.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.337 -0.852 . . . . 0.0 110.071 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.57 -31.65 14.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.393 -0.817 . . . . 0.0 110.218 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.11 -25.33 60.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.34 -0.85 . . . . 0.0 110.29 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.77 -28.04 20.74 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.248 -0.908 . . . . 0.0 110.255 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.24 -42.04 11.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.336 -0.852 . . . . 0.0 110.116 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -109.41 36.22 3.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.382 -0.824 . . . . 0.0 110.207 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.38 -75.46 0.04 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.8 pp -78.58 -23.43 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.337 -1.096 . . . . 0.0 110.386 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.44 59.13 3.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.353 -0.842 . . . . 0.0 110.21 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.8 p -147.02 157.91 43.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.345 -0.847 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p -84.63 -170.89 3.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.267 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.64 -104.02 0.23 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -137.46 79.3 1.74 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -1.088 . . . . 0.0 110.222 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.75 71.37 0.79 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.371 -0.831 . . . . 0.0 110.153 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.74 -58.67 4.23 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.316 -0.865 . . . . 0.0 110.373 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.1 m -113.85 69.57 0.71 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.406 -0.809 . . . . 0.0 110.332 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -77.28 -54.78 6.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.12 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.18 -27.11 60.66 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.22 -0.925 . . . . 0.0 109.084 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.39 -42.17 99.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.629 -0.829 . . . . 0.0 108.807 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.54 -30.38 70.67 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 tt -77.1 -35.22 56.56 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.569 -0.707 . . . . 0.0 109.774 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.79 -55.91 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.337 -179.907 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -44.29 67.19 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 110.536 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.2 m -67.06 -44.69 79.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.409 -0.807 . . . . 0.0 110.618 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.8 tp -80.52 -12.08 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.275 -0.891 . . . . 0.0 110.259 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.425 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.6 m -76.05 -41.52 50.45 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -82.26 -24.56 34.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.452 -0.78 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -86.05 -35.78 20.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.309 -0.869 . . . . 0.0 110.366 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.28 -45.03 50.29 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.297 -0.877 . . . . 0.0 110.34 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.78 -27.67 69.05 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.285 -0.885 . . . . 0.0 110.162 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.7 -48.38 42.97 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.415 ' HA ' ' HD2' ' A' ' 78' ' ' ARG . 7.8 tpt180 -99.86 132.14 45.4 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.405 -1.056 . . . . 0.0 110.013 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -145.37 -92.42 0.1 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.383 -0.823 . . . . 0.0 110.069 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -91.81 4.88 79.25 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.434 ' O ' ' CD1' ' A' ' 81' ' ' LEU . 0.3 OUTLIER -170.31 154.0 4.67 Favored Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.191 -1.182 . . . . 0.0 109.015 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.4 63.86 5.44 Favored 'Trans proline' 0 C--N 1.302 -1.881 0 O-C-N 123.535 1.282 . . . . 0.0 110.379 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -53.49 102.8 0.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.458 -0.776 . . . . 0.0 110.423 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.51 -25.27 13.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.844 . . . . 0.0 110.23 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.2 t -58.58 -25.46 62.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.339 -0.85 . . . . 0.0 110.295 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.1 p -95.5 -24.06 16.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.378 -0.827 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 21.7 mtt -76.15 125.15 28.62 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.347 -0.845 . . . . 0.0 110.176 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.9 p -77.92 -163.81 0.45 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 110.281 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.565 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.3 pt-20 -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.538 -0.726 . . . . 0.0 109.268 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.407 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.6 mt-10 -85.43 -40.07 16.84 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.01 -42.73 97.05 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -69.57 -34.9 74.83 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.565 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.67 -37.15 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.879 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.79 -34.87 79.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -77.82 -44.59 26.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.565 -0.709 . . . . 0.0 109.926 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.86 -33.38 72.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.369 -0.832 . . . . 0.0 110.065 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.9 tpp -80.58 -21.91 41.21 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.801 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -73.09 -38.9 66.22 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.459 -0.775 . . . . 0.0 110.028 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 92.6 mtp -84.55 -18.31 36.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.376 -0.828 . . . . 0.0 110.389 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.73 -24.8 22.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.203 -0.935 . . . . 0.0 110.277 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 tp -95.37 14.07 23.7 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.586 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -26.15 38.99 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.94 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 168.83 83.93 0.05 OUTLIER Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.85 80.63 3.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -1.087 . . . . 0.0 110.176 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.61 -62.25 2.0 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.839 . . . . 0.0 110.283 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.25 -68.16 0.4 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.396 -0.815 . . . . 0.0 110.18 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.1 -33.27 6.71 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -118.8 86.23 2.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.352 -1.087 . . . . 0.0 110.143 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -162.9 89.11 0.63 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.4 -0.813 . . . . 0.0 110.226 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -127.4 -60.35 1.19 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.431 -0.793 . . . . 0.0 110.185 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 t -77.29 -68.91 0.57 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.399 -0.813 . . . . 0.0 110.228 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.177 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.43 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.9 ttp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.131 0.491 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -89.98 139.87 30.19 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.335 -0.853 . . . . 0.0 109.779 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 21.9 pt -137.56 159.64 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.915 . . . . 0.0 110.353 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.92 143.54 42.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.713 -0.617 . . . . 0.0 110.517 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 65.0 t -128.02 121.07 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.321 -0.862 . . . . 0.0 109.854 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 mtpt -99.98 128.13 46.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.181 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.7 p -95.9 177.27 5.82 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.485 -0.759 . . . . 0.0 110.506 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.436 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.35 -14.46 27.46 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.557 -0.714 . . . . 0.0 110.956 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.7 p -95.61 17.74 14.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.154 -0.966 . . . . 0.0 110.683 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.12 11.06 58.11 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -85.0 132.63 34.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.08 -1.247 . . . . 0.0 109.816 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -113.19 125.19 54.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.396 -0.815 . . . . 0.0 110.273 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.447 HG22 HD12 ' B' ' 13' ' ' ILE . 21.7 mt -109.31 135.4 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 110.405 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.3 m -102.32 118.48 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.194 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -123.5 164.22 19.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.229 -0.92 . . . . 0.0 110.916 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -106.38 116.99 32.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.495 -0.753 . . . . 0.0 109.423 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.43 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.7 m -140.17 174.98 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.841 . . . . 0.0 110.746 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -113.1 165.81 12.43 Favored Pre-proline 0 N--CA 1.488 1.444 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.69 -26.13 16.53 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 123.617 1.325 . . . . 0.0 110.398 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.51 -4.0 58.71 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.057 -1.027 . . . . 0.0 110.508 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.22 138.84 49.82 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.54 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 68.0 p -83.37 160.24 21.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.482 -0.761 . . . . 0.0 110.248 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.412 HG12 ' CB ' ' B' ' 50' ' ' LEU . 1.7 mp -59.22 -28.98 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.93 -40.51 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 109.38 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -70.14 -31.36 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.544 -0.722 . . . . 0.0 109.483 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 81.8 t -70.16 -40.97 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.773 . . . . 0.0 109.27 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -62.99 -42.98 99.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.406 -0.809 . . . . 0.0 109.238 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -34.29 75.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.47 -0.769 . . . . 0.0 109.475 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 21.9 mttp -68.03 -39.97 83.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.524 -0.735 . . . . 0.0 109.674 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 18.7 mt -67.15 -37.68 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 0.0 109.071 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -52.08 66.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.813 . . . . 0.0 109.68 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -58.13 -27.63 63.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.451 -0.781 . . . . 0.0 110.643 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.03 -38.2 21.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.164 -0.96 . . . . 0.0 110.854 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -108.07 -56.43 2.24 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.226 -0.921 . . . . 0.0 110.502 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.15 17.64 1.98 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 19.9 mt -91.44 143.59 28.39 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.076 -1.249 . . . . 0.0 109.785 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.413 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -67.66 133.44 29.72 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.65 1.342 . . . . 0.0 110.415 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.69 -26.7 83.47 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.732 1.386 . . . . 0.0 110.849 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -24.89 64.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.84 . . . . 0.0 109.956 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.413 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.1 mt-30 -101.31 3.11 40.4 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.348 -0.845 . . . . 0.0 110.465 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -94.17 137.65 33.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.124 -0.985 . . . . 0.0 110.327 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -130.06 129.52 43.73 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.429 -0.794 . . . . 0.0 109.863 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 13.9 mt -104.45 116.89 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.397 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.417 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.0 mp -121.37 135.36 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.482 -0.761 . . . . 0.0 109.675 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -141.12 154.06 45.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 26.73 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.481 -0.762 . . . . 0.0 111.329 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.99 -3.74 74.54 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.159 -1.02 . . . . 0.0 110.621 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 136.93 49.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.976 -1.308 . . . . 0.0 110.31 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.29 134.92 37.45 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.21 -0.931 . . . . 0.0 109.832 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.449 HD21 ' CE2' ' B' ' 59' ' ' TYR . 26.7 mt -83.96 144.77 28.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -93.65 130.59 39.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.378 -0.826 . . . . 0.0 110.433 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -48.58 -26.83 2.41 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.522 -0.736 . . . . 0.0 111.435 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.64 -5.16 89.72 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -99.6 157.91 16.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.076 -1.249 . . . . 0.0 110.45 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 65.2 p -102.63 161.5 13.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.82 . . . . 0.0 110.212 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.7 mt -53.63 -47.34 70.36 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.389 -0.819 . . . . 0.0 110.626 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.8 t -56.74 -37.0 70.4 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.432 -0.793 . . . . 0.0 111.17 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.33 -26.62 65.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.147 -0.971 . . . . 0.0 110.24 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.449 ' CE2' HD21 ' B' ' 50' ' ' LEU . 25.3 m-85 -101.04 27.16 6.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.379 -0.826 . . . . 0.0 109.829 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.64 28.01 3.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.444 -0.785 . . . . 0.0 110.688 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.444 HD13 HG22 ' B' ' 61' ' ' ILE . 88.8 mt -81.56 112.01 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.362 -0.836 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -105.66 171.7 7.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.503 ' O ' ' HG2' ' B' ' 64' ' ' GLU . 0.9 OUTLIER -46.62 157.18 0.15 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.514 -0.741 . . . . 0.0 111.268 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.537 ' O ' ' HG3' ' B' ' 64' ' ' GLU . 0.0 OUTLIER 63.81 8.36 3.76 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.791 177.322 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -71.54 142.36 50.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.018 -1.051 . . . . 0.0 110.153 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 23.4 m -107.77 113.51 26.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.36 -0.837 . . . . 0.0 109.973 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.7 mt -102.18 164.18 11.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.33 -0.856 . . . . 0.0 110.048 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -108.58 128.87 55.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.32 -0.863 . . . . 0.0 109.959 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 48.0 tp -107.02 132.71 52.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.277 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 41.5 t -124.67 152.76 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.375 -0.828 . . . . 0.0 110.181 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 mt -94.53 107.71 19.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.397 -0.814 . . . . 0.0 110.247 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -77.56 131.87 38.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.314 -0.866 . . . . 0.0 110.13 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 97.2 mt -94.08 178.95 5.48 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.427 -0.795 . . . . 0.0 110.278 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.29 103.63 8.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.366 -0.834 . . . . 0.0 110.138 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.75 73.1 0.47 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 CA-C-O 117.97 -1.461 . . . . 0.0 109.54 -179.968 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.161 0.505 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.2 mtp -68.35 -176.57 0.77 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.357 -0.839 . . . . 0.0 110.14 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.0 tp -111.28 26.08 11.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.514 -0.742 . . . . 0.0 109.411 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -99.31 67.6 0.61 Allowed Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.49 -24.92 65.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.312 -1.111 . . . . 0.0 110.218 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.53 59.01 4.85 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.16 -54.99 0.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.364 -1.08 . . . . 0.0 110.182 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.5 t -86.17 -13.65 46.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 0.0 110.503 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -59.37 -19.52 47.47 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.302 -0.874 . . . . 0.0 110.428 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.448 ' O ' ' CD2' ' A' ' 10' ' ' PHE . 34.0 p90 -149.22 116.36 6.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.195 -0.941 . . . . 0.0 110.209 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -113.97 65.76 0.66 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.308 -0.87 . . . . 0.0 110.029 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 53.74 23.78 3.94 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.317 -0.864 . . . . 0.0 110.536 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -123.2 28.65 5.52 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 -51.4 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.425 -1.044 . . . . 0.0 109.982 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -122.11 164.05 28.0 Favored Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.489 -0.757 . . . . 0.0 109.416 179.934 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.505 ' HD2' ' CG ' ' A' ' 15' ' ' ASP . 34.8 Cg_endo -57.38 76.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.877 1.461 . . . . 0.0 111.793 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.506 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER 67.79 40.86 2.31 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.556 0.694 . . . . 0.0 109.924 179.391 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.458 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 41.99 31.61 0.24 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.165 0.507 . . . . 0.0 110.936 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.72 116.9 0.94 Allowed Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -71.26 -14.24 31.3 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.049 1.552 . . . . 0.0 109.894 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.96 -31.94 64.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.413 -0.804 . . . . 0.0 109.116 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.6 tp -84.34 -31.22 24.93 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.41 ' CB ' ' HB2' ' A' ' 16' ' ' PRO . . . -65.04 -34.85 79.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.583 -0.698 . . . . 0.0 109.32 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.6 tp -82.34 -32.5 29.3 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.603 -0.685 . . . . 0.0 109.803 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.24 -39.69 89.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.299 -0.875 . . . . 0.0 109.864 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.9 tp -83.04 -22.13 33.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.356 -0.84 . . . . 0.0 110.331 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -79.27 -32.28 43.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.263 -0.898 . . . . 0.0 108.583 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 63.1 t -84.45 -28.58 6.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.67 -46.14 66.77 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.558 -0.714 . . . . 0.0 109.853 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -68.84 -41.56 78.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.453 -0.779 . . . . 0.0 109.983 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -60.19 -39.14 85.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.419 -0.801 . . . . 0.0 110.028 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -38.59 88.54 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.469 -0.769 . . . . 0.0 109.863 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -62.35 -39.35 92.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.828 . . . . 0.0 110.008 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.09 89.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.37 -0.831 . . . . 0.0 109.896 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -33.54 75.71 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.377 -0.827 . . . . 0.0 109.853 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -40.53 18.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.414 -0.804 . . . . 0.0 109.975 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 7.7 mm-40 -71.49 -23.26 61.77 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.419 -0.8 . . . . 0.0 110.094 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -83.86 -58.11 2.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.48 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.76 -30.16 43.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.445 -0.784 . . . . 0.0 109.103 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -84.91 -39.14 18.55 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.758 -0.589 . . . . 0.0 109.506 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -68.02 -54.62 17.08 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.897 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.6 mtt-85 -59.92 -35.81 75.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.413 -0.804 . . . . 0.0 110.213 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -58.54 -39.16 79.42 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.211 -0.931 . . . . 0.0 109.96 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.83 -29.37 44.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.441 -0.787 . . . . 0.0 109.938 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.54 -30.21 62.93 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.461 -0.774 . . . . 0.0 110.04 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.52 -45.04 22.87 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.452 -0.78 . . . . 0.0 110.072 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.53 93.15 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.361 -0.837 . . . . 0.0 110.061 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -73.67 -43.25 59.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.424 -0.797 . . . . 0.0 110.061 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.75 -44.58 95.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 110.052 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.3 -26.86 68.24 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.505 -0.747 . . . . 0.0 110.134 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.52 21.75 16.19 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.387 -0.821 . . . . 0.0 110.195 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -143.68 -45.4 0.28 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 110.015 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.58 -44.93 38.54 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.6 tp -115.2 73.31 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.468 -1.019 . . . . 0.0 110.051 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.73 -151.18 0.08 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.335 -0.853 . . . . 0.0 110.059 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 12.9 p -52.62 145.14 12.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.205 -0.934 . . . . 0.0 110.44 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.5 m -73.78 -63.09 1.28 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.335 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.59 -99.81 0.14 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.674 -1.371 . . . . 0.0 109.674 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.6 m -124.32 100.24 6.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.374 -1.074 . . . . 0.0 110.273 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -167.56 102.93 0.5 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.304 -0.873 . . . . 0.0 110.106 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -146.37 -62.6 0.31 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 110.39 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.1 m -133.63 85.31 2.19 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.431 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -63.29 -33.63 75.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.327 -0.858 . . . . 0.0 110.095 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -75.31 -28.44 59.68 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.234 -0.916 . . . . 0.0 109.191 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.19 82.06 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.692 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -31.58 68.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.58 -42.58 58.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.479 -0.763 . . . . 0.0 109.511 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.2 OUTLIER -78.42 -53.06 7.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.471 -0.768 . . . . 0.0 110.321 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 ttp -53.55 -40.99 66.01 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.204 -0.935 . . . . 0.0 110.524 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.2 m -64.78 -47.38 78.34 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.6 tp -82.45 -11.69 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.9 . . . . 0.0 110.391 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 31.8 t -72.9 -46.85 50.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 109.8 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -81.85 -26.28 34.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.812 . . . . 0.0 109.908 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.04 -27.22 39.46 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.318 -0.864 . . . . 0.0 110.245 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -85.74 -49.23 8.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -48.35 79.52 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.393 -0.817 . . . . 0.0 110.165 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.01 -49.14 78.2 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.91 110.0 22.13 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.383 -1.069 . . . . 0.0 110.07 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -130.38 49.61 2.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.398 -0.814 . . . . 0.0 110.25 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.02 34.84 5.3 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -173.32 150.56 1.88 Allowed Pre-proline 0 N--CA 1.488 1.433 0 O-C-N 121.377 -1.072 . . . . 0.0 108.924 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -76.25 39.84 0.71 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 123.52 1.274 . . . . 0.0 110.8 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 50.78 56.41 8.03 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.139 -0.976 . . . . 0.0 110.62 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -24.07 67.68 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.289 -0.882 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.7 m -59.73 -19.49 50.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.327 -0.858 . . . . 0.0 110.515 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.1 t -98.14 -8.8 26.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.218 -0.926 . . . . 0.0 110.504 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.47 121.9 37.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.266 -0.896 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 66.4 p -77.66 -162.2 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.834 . . . . 0.0 110.376 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.55 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 pt-20 -69.39 -31.08 69.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.484 -0.76 . . . . 0.0 109.114 179.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.415 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.6 OUTLIER -85.27 -39.54 17.62 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -63.92 -46.08 86.39 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -65.63 -34.22 77.73 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.55 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.2 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.71 90.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.506 -0.746 . . . . 0.0 109.722 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -44.56 93.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.419 -0.801 . . . . 0.0 110.051 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.67 -31.1 61.81 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.863 . . . . 0.0 110.361 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.0 tpt -83.42 -24.97 31.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.367 -0.833 . . . . 0.0 110.023 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -38.29 63.58 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.0 110.081 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.7 mtm -81.26 -23.76 37.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.318 -0.864 . . . . 0.0 110.243 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.9 m -80.22 -29.15 38.5 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.307 -0.871 . . . . 0.0 110.454 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.81 -35.08 4.92 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.109 -0.994 . . . . 0.0 110.2 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -80.76 -46.82 7.01 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -110.06 67.99 0.66 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.413 -1.051 . . . . 0.0 110.161 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.88 -22.55 62.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.793 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -95.26 39.73 1.11 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.266 -0.896 . . . . 0.0 110.3 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -119.95 44.75 1.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -106.23 52.86 0.72 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.256 -1.144 . . . . 0.0 110.246 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.38 -50.11 0.15 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.273 -0.892 . . . . 0.0 110.194 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -89.14 84.26 6.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.386 -0.821 . . . . 0.0 110.182 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 -49.54 0.24 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.372 -0.83 . . . . 0.0 110.217 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.19 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.342 0.592 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -103.07 147.03 27.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.0 110.109 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 38.3 pt -137.52 158.28 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.4 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 79.5 m-85 -111.99 143.84 42.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.598 -0.689 . . . . 0.0 110.613 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 63.8 t -127.89 120.75 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.46 -0.775 . . . . 0.0 109.491 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.1 mtpt -100.03 129.81 46.12 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.409 -0.807 . . . . 0.0 110.568 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 32.2 p -95.81 175.98 6.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.401 -0.812 . . . . 0.0 110.283 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.16 -15.97 39.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.794 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.4 p -95.96 20.45 10.03 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.097 -1.002 . . . . 0.0 110.765 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.87 13.78 59.86 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.5 tttp -84.76 130.09 34.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.051 -1.264 . . . . 0.0 109.768 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.1 m -113.05 124.96 53.83 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.143 -0.973 . . . . 0.0 110.439 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 6.5 mt -109.32 133.23 55.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.409 -0.807 . . . . 0.0 110.259 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.4 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 11.7 m -102.38 118.76 37.55 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.371 -0.831 . . . . 0.0 109.564 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 67.9 mt -123.42 168.69 12.22 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.218 -0.926 . . . . 0.0 110.792 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.61 116.03 31.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.399 -0.813 . . . . 0.0 109.642 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 35.0 m -140.43 169.77 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.696 -179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -112.62 166.07 11.77 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.57 -0.706 . . . . 0.0 109.294 178.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.16 -25.63 18.82 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 123.538 1.283 . . . . 0.0 110.313 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -84.33 -3.56 58.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.506 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.21 141.41 50.63 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.178 -0.951 . . . . 0.0 110.465 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 46.4 p -83.17 157.13 22.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.54 -0.725 . . . . 0.0 110.367 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.413 HD12 HG23 ' B' ' 23' ' ' ILE . 43.0 mm -59.55 -35.3 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.292 -0.88 . . . . 0.0 109.435 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.16 -37.26 79.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.458 -0.776 . . . . 0.0 109.276 179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.32 -30.15 67.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.553 -0.717 . . . . 0.0 109.296 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.54 -41.44 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.468 -0.77 . . . . 0.0 109.16 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -62.85 -43.82 97.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.403 -0.81 . . . . 0.0 109.151 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -31.71 71.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.73 . . . . 0.0 109.289 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -68.35 -40.36 81.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.556 -0.715 . . . . 0.0 109.363 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.8 mt -67.09 -37.56 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.024 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 54.9 tt0 -60.78 -51.76 67.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.376 -0.827 . . . . 0.0 109.631 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.15 -27.1 63.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.433 -0.792 . . . . 0.0 110.592 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.93 -41.72 17.07 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.294 -0.879 . . . . 0.0 110.865 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -108.13 -53.72 2.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.217 -0.927 . . . . 0.0 110.427 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.5 19.74 2.04 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.151 -1.18 . . . . 0.0 110.151 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 51.8 mt -91.39 143.42 28.18 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.108 -1.231 . . . . 0.0 109.823 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.443 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.5 Cg_endo -69.69 133.04 24.74 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.663 1.349 . . . . 0.0 110.437 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.84 -25.78 81.86 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 O-C-N 123.705 1.371 . . . . 0.0 110.845 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -68.78 -25.2 64.58 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.304 -0.873 . . . . 0.0 109.88 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 29.5 mm-40 -101.33 5.16 42.19 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.433 -0.792 . . . . 0.0 110.46 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -94.26 141.82 28.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.0 110.425 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.12 124.46 32.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.447 -0.783 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 28.1 mt -104.6 118.19 35.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.217 -0.927 . . . . 0.0 110.274 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.403 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 1.8 mp -120.89 133.04 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.571 -0.706 . . . . 0.0 109.714 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -140.87 147.21 38.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.429 -0.794 . . . . 0.0 110.064 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.27 28.79 0.47 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.76 . . . . 0.0 111.191 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.49 2.91 85.72 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -111.13 134.79 52.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.045 -1.268 . . . . 0.0 110.243 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -78.46 134.46 37.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 109.406 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.445 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 35.0 mt -83.88 137.07 33.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.239 -0.913 . . . . 0.0 110.361 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -93.76 130.64 39.67 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.791 . . . . 0.0 110.41 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.408 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.39 -26.87 2.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.494 -0.754 . . . . 0.0 111.211 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.81 86.69 Favored Glycine 0 N--CA 1.494 2.547 0 C-N-CA 120.046 -1.073 . . . . 0.0 110.608 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -99.42 156.28 17.1 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.045 -1.268 . . . . 0.0 110.483 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.6 p -102.42 163.84 12.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.373 -0.829 . . . . 0.0 110.158 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 85.6 mt -53.5 -44.47 69.11 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.313 -0.867 . . . . 0.0 110.465 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 27.4 p -56.86 -36.31 69.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.398 -0.814 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.59 -27.96 66.73 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.099 -1.001 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.445 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 50.4 m-85 -101.13 27.54 6.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 109.93 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 50.6 28.2 3.34 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.604 -0.685 . . . . 0.0 110.683 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.438 HG23 HD13 ' B' ' 61' ' ' ILE . 90.9 mt -81.54 108.87 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.93 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.58 174.68 5.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.344 -0.847 . . . . 0.0 110.065 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.56 153.37 0.38 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.465 -0.772 . . . . 0.0 111.022 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 7.6 mt-10 62.64 16.32 8.77 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.667 -0.645 . . . . 0.0 110.681 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.55 142.05 50.08 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 20.3 m -107.64 109.93 21.67 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.334 -0.854 . . . . 0.0 110.115 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.2 mt -102.54 160.72 14.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.84 . . . . 0.0 110.101 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -108.83 132.66 53.79 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.306 -0.871 . . . . 0.0 110.043 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.7 tp -107.28 129.38 54.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.305 -0.872 . . . . 0.0 110.184 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.6 t -125.01 157.64 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.46 -0.775 . . . . 0.0 110.071 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.13 162.94 13.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.357 -0.839 . . . . 0.0 110.122 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -147.26 100.16 3.24 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.255 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mp -105.82 114.61 28.87 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.315 -0.865 . . . . 0.0 110.233 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -63.68 179.35 0.49 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.349 -0.844 . . . . 0.0 110.203 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 135.16 -36.92 1.99 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 CA-C-O 117.905 -1.497 . . . . 0.0 109.552 179.998 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.0 t60 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.232 0.539 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -167.36 -172.22 1.91 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.421 -0.799 . . . . 0.0 110.086 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt -113.44 26.57 10.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.441 -0.787 . . . . 0.0 109.643 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.59 64.9 1.42 Allowed Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -160.74 70.33 0.39 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.329 -1.101 . . . . 0.0 110.303 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -126.16 137.58 10.23 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.6 72.15 5.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -1.099 . . . . 0.0 110.16 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.6 p -148.94 -45.09 0.14 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.345 -0.847 . . . . 0.0 110.184 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.39 -34.98 68.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.395 -0.815 . . . . 0.0 110.151 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -97.89 14.58 26.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.334 -0.854 . . . . 0.0 110.426 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -76.57 82.79 3.24 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.861 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 52.75 42.42 31.77 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.405 -0.809 . . . . 0.0 110.359 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -138.96 20.92 3.02 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.403 HG21 ' N ' ' A' ' 15' ' ' ASP . 34.8 m -120.46 -31.85 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.2 -1.176 . . . . 0.0 110.374 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.509 ' CG ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -123.36 163.48 33.87 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.509 ' HD2' ' CG ' ' A' ' 15' ' ' ASP . 34.2 Cg_endo -56.8 76.11 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.956 1.503 . . . . 0.0 112.095 -178.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.499 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.1 t 67.88 36.51 3.43 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 121.541 0.686 . . . . 0.0 110.231 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.462 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 44.78 25.4 0.14 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.071 0.462 . . . . 0.0 111.153 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.94 117.44 0.52 Allowed Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.116 -0.99 . . . . 0.0 110.166 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -71.27 -14.17 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.012 1.533 . . . . 0.0 110.095 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -75.27 -32.67 61.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.38 -0.825 . . . . 0.0 109.322 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.77 -29.48 27.39 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.408 ' CB ' ' HB2' ' A' ' 16' ' ' PRO . . . -74.08 -36.08 64.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.592 -0.693 . . . . 0.0 109.447 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.9 tp -78.7 -34.89 45.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.581 -0.7 . . . . 0.0 109.69 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.82 -35.81 81.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.394 -0.816 . . . . 0.0 109.92 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.83 -23.14 45.23 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.486 -0.759 . . . . 0.0 110.207 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -27.46 38.78 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.285 -0.885 . . . . 0.0 109.333 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 57.7 t -80.79 -27.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.558 -0.714 . . . . 0.0 109.757 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 m -78.54 -31.76 47.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.386 -0.821 . . . . 0.0 110.036 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.55 -34.33 47.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.432 -0.793 . . . . 0.0 110.017 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.17 -32.73 63.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 110.068 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -73.74 -39.72 64.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -0.846 . . . . 0.0 110.25 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -64.53 -41.82 96.13 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.366 -0.834 . . . . 0.0 110.15 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.01 -39.99 90.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.301 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.86 -44.78 86.81 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.374 -0.828 . . . . 0.0 110.208 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -77.27 -43.28 33.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.361 -0.837 . . . . 0.0 110.123 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.7 mm100 -66.14 -28.21 68.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.828 . . . . 0.0 110.211 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -83.98 -57.89 3.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.449 -0.782 . . . . 0.0 109.777 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.06 -34.28 42.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.426 -0.796 . . . . 0.0 109.347 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.41 -34.1 28.39 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.422 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.58 -49.43 71.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.431 -0.793 . . . . 0.0 109.828 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.22 -32.22 64.62 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.894 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -53.79 -36.43 62.43 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.214 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.1 -27.22 35.69 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.546 -0.721 . . . . 0.0 109.126 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.03 -29.5 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.553 -0.717 . . . . 0.0 109.843 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.91 -38.02 13.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.451 -0.78 . . . . 0.0 110.014 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.94 -36.95 70.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.784 . . . . 0.0 110.077 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -37.63 47.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.44 -0.787 . . . . 0.0 109.975 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.68 -29.13 70.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.823 . . . . 0.0 110.073 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.44 -21.83 57.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.452 -0.78 . . . . 0.0 110.293 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -76.59 -62.6 1.57 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.261 -0.9 . . . . 0.0 110.237 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -119.78 36.94 4.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.408 -0.808 . . . . 0.0 110.359 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -129.43 -60.93 0.1 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.5 mm -90.4 73.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -1.045 . . . . 0.0 110.096 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -167.91 63.2 0.07 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.324 -0.86 . . . . 0.0 110.188 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.41 133.36 37.52 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.341 -0.85 . . . . 0.0 110.077 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 24.7 m -132.51 120.7 22.24 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.31 43.28 0.4 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -115.03 53.07 0.83 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -1.136 . . . . 0.0 110.19 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.54 56.86 1.15 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.267 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -62.27 -63.36 1.26 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.277 -0.889 . . . . 0.0 110.131 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -84.81 78.81 9.81 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.351 -0.843 . . . . 0.0 110.049 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.39 -61.87 1.64 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.336 -0.852 . . . . 0.0 110.35 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -77.67 -28.67 51.2 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.183 -0.948 . . . . 0.0 109.517 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.26 79.89 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.414 -0.915 . . . . 0.0 108.786 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.414 ' O ' ' CG2' ' A' ' 70' ' ' THR . 14.1 tp -73.04 -30.94 64.11 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -77.55 -34.35 53.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.595 -0.69 . . . . 0.0 109.669 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.406 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.1 OUTLIER -84.63 -51.29 6.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 109.926 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.33 -38.62 63.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.275 -0.891 . . . . 0.0 110.425 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.414 ' CG2' ' O ' ' A' ' 66' ' ' LEU . 14.4 t -74.59 -36.27 63.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.243 -0.911 . . . . 0.0 110.474 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.447 HG13 ' CB ' ' A' ' 75' ' ' GLU . 3.4 tp -85.45 -14.01 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.387 -0.821 . . . . 0.0 110.323 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' LYS . 35.5 t -83.82 -33.41 24.93 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.926 . . . . 0.0 109.992 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.86 -24.31 19.38 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.299 -0.876 . . . . 0.0 110.185 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -32.9 10.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.32 -0.863 . . . . 0.0 110.232 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.462 ' C ' ' CG ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -110.5 -12.97 14.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.366 -0.834 . . . . 0.0 110.607 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.462 ' CG ' ' C ' ' A' ' 75' ' ' GLU . 13.9 p90 31.49 57.89 0.29 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.567 -0.708 . . . . 0.0 111.769 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.51 -63.73 3.12 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -43.01 6.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.411 -1.053 . . . . 0.0 110.016 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.44 ' O ' ' CG2' ' A' ' 79' ' ' THR . 67.1 m 51.73 26.07 3.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.343 -0.848 . . . . 0.0 110.022 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 94.01 -89.42 1.27 Allowed Glycine 0 N--CA 1.489 2.228 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.412 ' CG ' ' O ' ' A' ' 80' ' ' GLY . 0.2 OUTLIER -178.18 146.87 0.57 Allowed Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.529 -0.983 . . . . 0.0 109.154 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.49 50.68 2.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.517 1.272 . . . . 0.0 110.523 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.32 84.74 1.43 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.244 -0.91 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 -28.79 63.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.374 -0.829 . . . . 0.0 110.201 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.8 m -59.2 -24.63 63.28 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.347 -0.845 . . . . 0.0 110.58 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.7 t -99.85 -25.17 14.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.34 -0.85 . . . . 0.0 110.447 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.5 mtt -75.16 120.41 20.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -0.885 . . . . 0.0 110.161 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.481 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 77.4 p -74.0 -158.07 0.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.498 -0.751 . . . . 0.0 110.426 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.584 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 2.8 mt-10 -73.53 -29.85 62.72 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.559 -0.713 . . . . 0.0 109.077 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.402 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 31.7 mt-10 -85.09 -36.97 20.81 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.481 ' HB2' ' N ' ' A' ' 88' ' ' THR . 7.8 mm-40 -66.19 -45.27 81.42 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -66.47 -34.79 78.73 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.584 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -65.61 -36.24 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 178.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.41 71.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.494 -0.754 . . . . 0.0 109.613 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -84.52 -46.13 11.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.462 -0.774 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.44 -30.92 67.89 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.417 -0.802 . . . . 0.0 110.505 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.4 ttm -82.3 -25.52 33.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.285 -0.884 . . . . 0.0 109.971 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.06 -33.13 65.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 110.147 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 mtt -87.33 -25.87 23.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.465 -0.772 . . . . 0.0 110.316 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.4 t -76.49 -43.32 40.11 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.361 -0.837 . . . . 0.0 110.548 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -68.03 -32.38 72.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.343 -0.848 . . . . 0.0 110.338 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -60.97 -66.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.409 -0.807 . . . . 0.0 110.309 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 156.47 -117.94 0.81 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -169.28 79.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.344 -1.092 . . . . 0.0 110.161 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -86.67 74.82 9.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.346 -0.846 . . . . 0.0 110.207 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -164.28 -66.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.377 -0.827 . . . . 0.0 110.128 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -111.75 -171.14 18.86 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.98 69.36 1.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.301 -1.117 . . . . 0.0 110.279 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.16 -38.7 22.01 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.402 -0.811 . . . . 0.0 110.173 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -77.97 -38.09 45.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.395 -0.816 . . . . 0.0 110.148 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.48 121.11 25.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.382 -0.824 . . . . 0.0 110.046 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 179.982 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.137 0.494 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.24 140.71 29.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.797 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.8 pt -137.38 159.79 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.906 . . . . 0.0 110.291 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.98 143.62 42.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.576 -0.703 . . . . 0.0 110.686 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 82.4 t -127.72 116.87 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.447 -0.783 . . . . 0.0 109.352 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -100.18 131.87 45.87 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.345 -0.847 . . . . 0.0 110.813 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 17.5 p -95.99 173.34 7.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.878 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.66 -12.01 14.31 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.343 -0.848 . . . . 0.0 110.941 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 63.8 p -95.65 16.06 18.31 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.036 -1.04 . . . . 0.0 110.767 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.36 8.59 66.46 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 120.195 -1.003 . . . . 0.0 110.629 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -84.75 127.27 34.03 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.052 -1.264 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 3.5 m -113.24 126.84 55.85 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.977 . . . . 0.0 110.495 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 13.1 mt -109.46 136.67 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.358 -0.839 . . . . 0.0 110.439 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m -102.3 120.52 40.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.1 mt -123.49 162.22 23.31 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.117 -0.99 . . . . 0.0 110.857 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -106.55 116.15 31.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.475 -0.765 . . . . 0.0 109.664 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.424 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.24 176.45 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 110.787 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -113.14 163.24 18.62 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.44 -26.69 20.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.513 1.27 . . . . 0.0 110.276 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 m -84.54 -2.48 57.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.261 -0.9 . . . . 0.0 110.614 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -71.36 145.15 49.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.541 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.33 156.33 23.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.661 -0.65 . . . . 0.0 110.432 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.403 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.7 mm -59.61 -32.75 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 109.431 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -62.58 -36.74 83.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -70.21 -31.51 68.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.514 -0.742 . . . . 0.0 109.124 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.99 -40.37 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttt -62.92 -40.6 98.12 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -34.75 76.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 109.348 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.9 -39.99 83.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.571 -0.706 . . . . 0.0 109.554 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.0 mt -67.31 -37.62 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.152 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.4 tm0? -60.87 -53.33 58.62 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.469 -0.769 . . . . 0.0 109.833 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.1 -27.73 63.98 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.386 -0.821 . . . . 0.0 110.746 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -84.12 -36.52 22.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 111.167 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -108.07 -53.14 2.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.202 -0.936 . . . . 0.0 110.602 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.61 14.15 3.6 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 69.2 mt -91.37 143.25 27.94 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.107 -1.231 . . . . 0.0 109.874 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 38.7 Cg_endo -67.4 135.39 36.43 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.61 1.321 . . . . 0.0 110.391 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 -24.74 79.32 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.727 1.383 . . . . 0.0 111.001 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.73 -25.38 64.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.317 -0.865 . . . . 0.0 109.804 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.529 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.58 6.87 44.27 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.533 -0.73 . . . . 0.0 110.541 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -94.3 139.52 30.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.445 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.1 122.82 29.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.452 -0.78 . . . . 0.0 109.845 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 28.0 mt -104.7 116.69 32.47 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.481 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.412 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 1.9 mp -121.12 133.78 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.553 -0.717 . . . . 0.0 109.658 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -140.39 151.64 45.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.458 -0.776 . . . . 0.0 109.807 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.38 28.14 0.44 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.472 -0.768 . . . . 0.0 111.048 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.52 2.31 79.72 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -111.13 138.3 47.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.246 . . . . 0.0 110.292 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -78.39 135.88 37.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.9 . . . . 0.0 109.459 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.433 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 39.8 mt -83.79 138.45 33.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 110.315 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -93.67 127.76 39.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.387 -0.821 . . . . 0.0 110.6 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.403 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.33 -26.42 2.02 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 111.135 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -10.45 82.95 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.733 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.25 158.3 15.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.31 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 41.3 p -102.39 166.15 10.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.768 . . . . 0.0 110.373 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.4 mt -53.64 -44.21 69.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.317 -0.864 . . . . 0.0 110.751 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 94.0 p -56.83 -36.77 70.36 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.342 -0.849 . . . . 0.0 111.153 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.55 -27.06 65.89 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.135 -0.978 . . . . 0.0 110.532 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.433 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 55.2 m-85 -101.06 24.72 8.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.883 . . . . 0.0 110.221 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 50.69 30.33 4.86 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.4 -0.813 . . . . 0.0 110.723 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.464 HG23 HD11 ' B' ' 61' ' ' ILE . 73.5 mt -81.67 113.45 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.29 -0.881 . . . . 0.0 110.015 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.78 170.47 7.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.9 . . . . 0.0 110.262 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -46.74 153.28 0.41 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.568 -0.707 . . . . 0.0 111.103 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 62.84 16.1 8.8 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.611 -0.68 . . . . 0.0 110.874 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.56 144.59 49.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.153 -0.967 . . . . 0.0 110.082 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.7 m -107.53 110.49 22.43 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -102.42 162.62 12.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.368 -0.832 . . . . 0.0 110.213 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -109.03 130.58 55.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.363 -0.835 . . . . 0.0 109.941 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 55.0 tp -106.97 127.75 53.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 48.6 t -124.8 155.0 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.303 -0.873 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.8 mt -94.18 128.12 40.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.442 -0.786 . . . . 0.0 110.25 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -86.16 70.95 10.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.357 -0.839 . . . . 0.0 110.15 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.36 -176.94 3.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.36 -0.837 . . . . 0.0 110.347 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.67 131.33 3.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.376 -0.827 . . . . 0.0 110.015 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.39 114.36 0.06 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 CA-C-O 117.987 -1.452 . . . . 0.0 109.539 -179.908 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 39.2 m80 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.125 0.488 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.8 mtp -152.04 -174.09 4.75 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.458 -0.776 . . . . 0.0 110.14 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.52 23.87 13.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.0 109.482 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.86 50.32 3.14 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.45 35.29 2.9 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.323 -1.104 . . . . 0.0 110.225 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.2 105.12 0.3 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.58 60.79 4.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.387 -1.066 . . . . 0.0 110.147 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -152.28 -46.04 0.1 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.335 -0.853 . . . . 0.0 110.155 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -61.53 -41.13 96.87 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.379 -0.826 . . . . 0.0 110.159 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -108.42 63.78 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.456 -0.778 . . . . 0.0 110.06 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.99 136.42 36.6 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.36 -0.837 . . . . 0.0 110.347 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 53.18 24.35 3.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.284 -0.885 . . . . 0.0 110.568 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -137.59 28.36 2.76 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.4 t -117.69 -33.83 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.365 -1.079 . . . . 0.0 110.122 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.538 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -138.63 -178.89 0.92 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.418 -0.801 . . . . 0.0 109.908 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.538 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 36.9 Cg_endo -61.13 78.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 123.536 1.282 . . . . 0.0 110.691 -178.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.455 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.1 m 69.04 46.32 0.83 Allowed 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 41.65 30.21 0.14 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.055 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -164.24 116.27 0.98 Allowed Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.238 -0.914 . . . . 0.0 110.544 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -72.62 -14.05 27.34 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.14 1.6 . . . . 0.0 109.656 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.425 ' HB3' ' CG1' ' B' ' 70' ' ' VAL . 31.5 mt-10 -72.67 -35.99 67.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.452 -0.78 . . . . 0.0 109.293 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.5 mt -79.47 -31.11 42.34 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.41 75.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.554 -0.716 . . . . 0.0 109.105 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.59 -34.84 27.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.627 -0.671 . . . . 0.0 109.621 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.51 -34.19 67.44 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.391 -0.818 . . . . 0.0 109.724 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 26.6 mt -82.72 -21.04 34.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.284 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.3 -34.67 55.44 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.28 -0.888 . . . . 0.0 108.746 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 91.4 t -79.38 -24.76 12.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.742 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 p -73.28 -46.69 48.3 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.378 -0.826 . . . . 0.0 110.189 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -37.93 82.8 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.4 -0.813 . . . . 0.0 110.169 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -29.28 67.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.432 -0.792 . . . . 0.0 110.098 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.66 -43.67 62.85 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.294 -0.879 . . . . 0.0 110.094 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -69.14 -33.13 72.95 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.328 -0.857 . . . . 0.0 110.057 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.7 -44.59 66.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.103 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.95 -29.23 69.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.361 -0.837 . . . . 0.0 110.332 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.5 mmt85 -86.85 -31.86 20.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.448 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.1 mt-30 -77.24 -27.67 53.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.406 -0.809 . . . . 0.0 110.112 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -84.05 -57.49 3.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.334 -0.854 . . . . 0.0 109.709 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -52.6 -30.97 34.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 109.377 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -87.0 -34.39 19.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.565 -0.709 . . . . 0.0 109.653 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.448 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -71.06 -54.22 11.91 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.22 -0.925 . . . . 0.0 109.982 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.3 mtt-85 -62.08 -48.14 81.54 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.391 -0.818 . . . . 0.0 110.165 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -54.1 -44.5 71.28 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.38 -29.98 60.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.387 -0.821 . . . . 0.0 109.589 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.8 -28.65 64.8 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.412 -0.805 . . . . 0.0 109.877 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.67 -36.91 14.09 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.458 -0.776 . . . . 0.0 110.218 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.75 -31.19 64.74 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.9 m -84.82 -35.54 22.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.414 -0.804 . . . . 0.0 110.239 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.7 67.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.276 -0.89 . . . . 0.0 110.245 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.27 -28.38 47.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.349 -0.844 . . . . 0.0 110.164 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.78 -37.0 27.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.145 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -106.86 24.8 12.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.417 -0.802 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -122.09 -40.66 0.51 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.9 mm -85.03 -27.4 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.4 -1.059 . . . . 0.0 110.153 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.58 -51.89 17.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -0.892 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.1 t -67.18 155.6 38.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.347 -0.845 . . . . 0.0 110.168 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.7 m -85.34 100.83 12.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.293 -0.879 . . . . 0.0 110.155 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -142.3 45.87 0.9 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.1 m -92.18 52.09 1.9 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -1.116 . . . . 0.0 110.138 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -110.41 84.97 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -167.53 -48.77 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.321 -0.862 . . . . 0.0 110.299 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.26 68.35 1.14 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.337 -0.852 . . . . 0.0 110.217 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.78 -30.79 70.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.384 -0.822 . . . . 0.0 110.323 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -75.9 -29.78 58.58 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.239 -0.913 . . . . 0.0 109.163 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.84 -36.29 82.73 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.434 -0.906 . . . . 0.0 108.69 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -29.09 64.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.5 tt -78.73 -37.68 40.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.51 -0.744 . . . . 0.0 109.803 179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -84.04 -50.71 7.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.5 -0.75 . . . . 0.0 110.38 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.3 tpp -57.64 -42.97 84.52 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.264 -0.898 . . . . 0.0 110.438 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.8 m -68.35 -41.73 80.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.337 -0.852 . . . . 0.0 110.571 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.3 tp -82.95 -14.98 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.253 -0.904 . . . . 0.0 110.28 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' LYS . 8.2 t -74.15 -45.33 49.43 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.889 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -79.59 -26.42 41.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.44 -0.788 . . . . 0.0 109.956 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -81.65 -40.98 22.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.347 -0.846 . . . . 0.0 110.153 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.84 -44.92 79.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.348 -0.845 . . . . 0.0 110.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.58 94.04 0.08 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.403 -0.811 . . . . 0.0 110.226 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.94 78.8 0.04 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' GLY . 2.2 tmm_? 53.4 57.58 6.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.344 -1.092 . . . . 0.0 110.373 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.417 ' O ' ' CG2' ' A' ' 79' ' ' THR . 6.8 t -63.37 80.1 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.39 -0.819 . . . . 0.0 109.567 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 75.92 -57.04 3.11 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.45 ' CG ' ' O ' ' A' ' 80' ' ' GLY . 0.2 OUTLIER 174.85 147.08 0.23 Allowed Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.633 -0.922 . . . . 0.0 109.136 179.418 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.31 50.72 1.97 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.505 1.266 . . . . 0.0 110.268 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -54.3 105.62 0.16 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.85 -27.99 61.37 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.378 -0.826 . . . . 0.0 110.023 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.7 t -57.77 -27.47 63.1 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.267 -0.896 . . . . 0.0 110.242 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.4 m -87.02 -27.89 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.354 -0.842 . . . . 0.0 110.106 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.7 mtt -63.27 114.26 3.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.828 . . . . 0.0 110.196 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p -75.66 -159.94 0.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.807 . . . . 0.0 110.574 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.56 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.1 mt-10 -71.92 -30.32 65.23 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mm-40 -83.85 -38.07 21.66 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -45.24 85.3 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.07 -34.2 77.52 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.56 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -67.37 -33.67 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.74 -28.9 69.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.398 -0.814 . . . . 0.0 109.8 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.78 -39.31 20.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.411 -0.806 . . . . 0.0 110.355 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.95 -29.3 32.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.282 -0.886 . . . . 0.0 110.724 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 tpt -82.27 -27.47 32.38 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.39 -28.84 41.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.478 -0.764 . . . . 0.0 109.764 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.7 ttp -81.55 -26.08 35.34 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.46 -0.775 . . . . 0.0 110.256 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -83.07 -31.8 27.15 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.261 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -36.42 65.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.317 -0.864 . . . . 0.0 110.06 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -86.33 -24.25 25.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.267 -0.895 . . . . 0.0 110.329 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -134.04 97.51 0.3 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.25 67.69 6.16 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.362 -1.081 . . . . 0.0 110.291 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 51.74 44.42 29.28 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.306 -0.871 . . . . 0.0 110.544 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -98.25 31.03 2.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.453 -0.78 . . . . 0.0 110.306 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -96.9 84.06 0.78 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -91.16 50.64 1.8 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.345 -1.091 . . . . 0.0 110.228 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -114.64 -24.71 8.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.352 -0.842 . . . . 0.0 110.399 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -95.79 38.51 1.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.286 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.79 -31.3 25.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.308 -0.87 . . . . 0.0 110.17 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.196 179.886 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.461 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.0 ttp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.213 0.53 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -88.21 138.69 31.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 109.855 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.6 pt -137.42 158.82 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.343 -0.848 . . . . 0.0 110.365 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.421 ' CE1' HG23 ' B' ' 14' ' ' THR . 83.7 m-85 -111.84 142.55 44.07 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.616 -0.677 . . . . 0.0 110.628 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t -127.97 119.59 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.383 -0.823 . . . . 0.0 109.507 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.409 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.7 mtpm? -100.32 131.15 46.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.803 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.2 p -96.21 176.86 5.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 110.18 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.62 -15.08 36.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.449 -0.782 . . . . 0.0 110.954 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 78.0 p -95.8 19.88 10.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.041 -1.037 . . . . 0.0 110.767 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.91 12.83 58.26 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.409 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.06 34.86 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.242 . . . . 0.0 109.729 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 25.1 m -112.88 126.75 55.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.273 -0.892 . . . . 0.0 110.42 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.3 mt -109.31 138.54 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.39 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.421 HG23 ' CE1' ' B' ' 4' ' ' PHE . 4.3 m -101.93 119.71 39.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.0 109.13 179.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.0 mt -123.47 160.68 26.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.055 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 114.91 29.32 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.527 -0.733 . . . . 0.0 109.409 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.461 ' O ' ' HB3' ' B' ' 1' ' ' MET . 28.4 m -140.16 176.99 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 110.882 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -113.29 164.21 16.26 Favored Pre-proline 0 N--CA 1.49 1.536 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.9 -26.07 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 123.543 1.286 . . . . 0.0 110.346 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 -3.13 58.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.212 -0.93 . . . . 0.0 110.739 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.27 144.1 50.14 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.139 -0.976 . . . . 0.0 110.617 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 67.5 p -83.15 158.48 22.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.535 -0.728 . . . . 0.0 110.206 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.448 HD12 HG23 ' B' ' 23' ' ' ILE . 43.7 mm -59.58 -36.97 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 109.542 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.74 -35.46 76.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.453 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -70.44 -32.99 70.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.468 -0.77 . . . . 0.0 109.351 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.94 -39.8 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.0 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.6 mtmt -62.99 -41.19 99.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 109.036 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.42 77.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.573 -0.704 . . . . 0.0 109.391 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -37.5 81.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.437 -0.789 . . . . 0.0 109.388 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.4 mt -67.18 -37.46 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.769 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -60.71 -51.28 70.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.549 -0.719 . . . . 0.0 109.531 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -58.13 -27.25 63.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.55 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -84.07 -39.47 19.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.214 -0.929 . . . . 0.0 110.841 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -108.16 -55.75 2.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.249 -0.907 . . . . 0.0 110.6 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.2 14.24 2.03 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.411 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 13.8 mt -91.17 143.81 28.95 Favored Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.115 -1.227 . . . . 0.0 109.573 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.411 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 40.7 Cg_endo -68.38 131.74 23.99 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 O-C-N 123.631 1.332 . . . . 0.0 110.6 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.01 -25.41 81.44 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.719 1.378 . . . . 0.0 110.777 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -68.69 -24.13 64.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 109.768 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -101.19 2.59 40.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.455 -0.778 . . . . 0.0 110.427 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -94.35 141.95 27.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.234 -0.916 . . . . 0.0 110.473 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.36 131.77 45.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.529 -0.732 . . . . 0.0 109.801 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.62 120.86 42.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.349 -0.844 . . . . 0.0 110.467 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.402 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 1.8 mp -121.08 133.01 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.496 -0.753 . . . . 0.0 109.65 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -140.65 150.66 43.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.416 -0.803 . . . . 0.0 110.16 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.68 0.46 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.457 -0.777 . . . . 0.0 111.217 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.48 80.27 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -110.97 137.46 48.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.968 -1.313 . . . . 0.0 110.239 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.49 134.35 37.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.397 -0.814 . . . . 0.0 109.688 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.465 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 31.9 mt -83.8 141.04 31.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.232 -0.917 . . . . 0.0 110.306 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -93.49 129.32 39.73 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.358 -0.839 . . . . 0.0 110.524 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.413 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 73.1 m-20 -48.29 -26.11 1.86 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.734 . . . . 0.0 111.229 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.78 -9.31 84.72 Favored Glycine 0 N--CA 1.493 2.482 0 C-N-CA 120.139 -1.029 . . . . 0.0 110.553 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -99.35 156.8 16.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.994 -1.297 . . . . 0.0 110.483 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 31.8 p -102.38 167.65 9.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 110.181 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 86.6 mt -53.69 -47.02 70.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.255 -0.903 . . . . 0.0 110.629 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.76 -34.71 67.85 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.368 -0.833 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.63 -29.46 68.03 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.152 -0.967 . . . . 0.0 110.384 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.465 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 47.3 m-85 -101.24 28.97 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.835 . . . . 0.0 109.867 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.69 28.43 3.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.593 -0.692 . . . . 0.0 110.785 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.47 HG23 HD11 ' B' ' 61' ' ' ILE . 97.4 mt -81.36 108.54 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 109.741 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -105.73 173.53 6.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.379 -0.826 . . . . 0.0 110.366 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.4 OUTLIER -46.55 152.36 0.47 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.526 -0.734 . . . . 0.0 110.933 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.6 mm-40 62.97 15.87 8.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.701 -0.624 . . . . 0.0 110.59 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 144.93 49.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 0.0 110.079 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -107.56 106.83 17.38 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.33 -0.856 . . . . 0.0 109.929 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.4 mt -102.57 160.49 14.52 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -108.88 135.91 49.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -0.885 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.2 tp -107.13 131.65 53.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.291 -0.881 . . . . 0.0 110.411 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.425 ' CG1' ' HB3' ' A' ' 21' ' ' GLU . 19.4 t -125.09 149.27 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.395 -0.816 . . . . 0.0 110.121 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 26.7 mt -94.69 91.47 6.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.411 -0.806 . . . . 0.0 110.278 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 71.17 3.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.353 -0.842 . . . . 0.0 110.24 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.14 160.63 2.8 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.298 -0.876 . . . . 0.0 110.391 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.36 89.2 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.326 -0.859 . . . . 0.0 110.409 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -132.6 -111.41 1.3 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.989 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.194 0.521 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -167.53 -168.54 1.05 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.84 23.22 14.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.457 -0.777 . . . . 0.0 109.526 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.63 -24.77 49.0 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 54.3 57.64 5.68 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.384 -1.068 . . . . 0.0 110.34 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.1 84.94 0.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.709 -1.357 . . . . 0.0 109.709 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.3 72.12 0.42 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.321 -1.105 . . . . 0.0 110.534 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.8 t -165.55 -53.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.408 -0.807 . . . . 0.0 109.938 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -68.06 -26.88 66.08 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.409 -0.807 . . . . 0.0 110.12 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -101.67 42.66 1.11 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.359 -0.838 . . . . 0.0 110.228 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -146.14 34.15 0.99 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.409 -0.807 . . . . 0.0 109.981 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -163.43 40.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.403 -0.811 . . . . 0.0 110.054 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 162.3 -29.88 0.28 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.8 p -96.86 -23.47 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.419 -1.048 . . . . 0.0 110.223 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.74 171.77 0.15 Allowed Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.489 -0.757 . . . . 0.0 110.444 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.95 -22.71 26.27 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 O-C-N 123.86 1.452 . . . . 0.0 110.616 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -66.68 -14.53 62.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.279 -0.888 . . . . 0.0 110.455 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.73 -34.25 30.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.282 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -169.49 118.67 0.57 Allowed Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.36 -0.837 . . . . 0.0 110.063 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.39 -14.69 34.34 Favored 'Trans proline' 0 C--N 1.306 -1.658 0 O-C-N 123.984 1.518 . . . . 0.0 109.989 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -73.95 -31.14 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.261 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.92 -31.11 23.83 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.82 77.86 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.5 -0.75 . . . . 0.0 109.438 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.75 -35.96 38.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.453 -0.78 . . . . 0.0 109.664 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.406 ' CB ' HD11 ' B' ' 44' ' ' ILE . . . -77.67 -31.89 52.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.422 -0.798 . . . . 0.0 110.038 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -78.03 -21.52 50.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.436 -0.79 . . . . 0.0 110.178 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.37 -35.52 30.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 108.96 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 89.6 t -71.41 -31.15 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.62 -0.675 . . . . 0.0 109.53 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -72.94 -41.29 64.63 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.469 -0.77 . . . . 0.0 109.915 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 mtt -62.77 -31.06 71.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.426 -0.796 . . . . 0.0 109.928 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -31.6 62.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 110.016 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -43.92 46.24 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.413 -0.804 . . . . 0.0 110.014 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -45.39 90.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.054 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.59 -35.69 80.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.381 -0.825 . . . . 0.0 110.056 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -54.89 41.72 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.37 -0.831 . . . . 0.0 110.268 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mtt-85 -62.63 -48.5 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.455 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 8.8 mt-30 -63.0 -27.16 69.23 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.336 -0.853 . . . . 0.0 110.191 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -76.67 -53.41 8.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.487 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -55.15 -33.78 63.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 108.977 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.39 -35.54 23.06 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.722 -0.612 . . . . 0.0 109.571 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -71.15 -55.91 7.18 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.762 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -56.5 -43.53 79.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.512 -0.743 . . . . 0.0 110.229 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.6 ttm180 -54.78 -43.03 72.46 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.3 -0.875 . . . . 0.0 109.906 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.07 -27.59 57.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.448 -0.783 . . . . 0.0 109.785 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.97 -27.12 54.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.431 -0.793 . . . . 0.0 110.081 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.67 -45.3 19.28 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 110.032 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -29.13 66.63 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.158 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -83.35 -34.8 25.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.366 -0.834 . . . . 0.0 110.193 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.56 -38.75 74.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.074 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.22 -15.31 60.06 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.357 -0.84 . . . . 0.0 110.327 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -103.87 -42.42 5.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.243 -0.911 . . . . 0.0 110.374 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.31 29.7 5.99 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.301 -0.874 . . . . 0.0 110.381 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -110.88 -61.72 0.49 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.1 mp -100.61 -15.94 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -1.103 . . . . 0.0 110.447 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.12 80.86 0.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.172 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -153.62 67.14 0.76 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.4 t -144.53 96.75 2.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.16 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.74 -120.44 0.53 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.8 t -167.48 46.31 0.05 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.461 -1.023 . . . . 0.0 110.266 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -101.25 48.68 0.89 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.333 -0.854 . . . . 0.0 110.127 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.58 -46.6 30.92 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.407 -0.808 . . . . 0.0 110.254 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.76 70.52 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 110.17 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -77.36 -51.26 11.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.38 -32.48 58.59 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.205 -0.934 . . . . 0.0 109.21 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.69 80.86 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 108.901 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mp -70.16 -30.68 67.88 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.407 ' CD1' ' C ' ' A' ' 67' ' ' LEU . 3.1 tm? -73.87 -42.95 60.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.453 -0.779 . . . . 0.0 109.46 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -80.41 -53.25 6.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.424 -0.797 . . . . 0.0 110.599 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -53.77 -38.51 64.51 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.109 -0.995 . . . . 0.0 110.623 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 47.3 m -70.31 -41.36 73.4 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.264 -0.898 . . . . 0.0 110.494 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.8 tp -84.34 -14.55 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.173 -0.954 . . . . 0.0 110.368 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -75.66 -44.67 41.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.284 -0.885 . . . . 0.0 109.658 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -79.06 -27.04 43.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.483 -0.761 . . . . 0.0 109.967 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -81.97 -49.04 10.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.359 -0.838 . . . . 0.0 110.229 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.75 -37.87 83.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.223 -0.923 . . . . 0.0 110.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -98.44 102.25 13.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.354 -0.841 . . . . 0.0 110.015 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -142.31 88.97 0.18 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.3 100.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.36 -1.083 . . . . 0.0 110.419 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.3 m -127.44 44.43 2.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.172 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.02 24.39 32.49 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.739 -1.345 . . . . 0.0 109.739 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.74 149.78 1.31 Allowed Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.274 -1.133 . . . . 0.0 108.967 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -72.17 63.18 3.43 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 123.556 1.292 . . . . 0.0 110.363 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -70.0 134.73 48.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.433 -0.792 . . . . 0.0 110.358 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.2 mt -117.42 -39.41 3.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.395 -0.816 . . . . 0.0 110.045 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 m -75.5 -2.66 29.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.416 -0.802 . . . . 0.0 110.683 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -109.27 12.2 24.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.005 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.9 mtt -111.36 -159.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -0.877 . . . . 0.0 109.952 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p -137.79 -171.78 3.08 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.27 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.581 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.5 pt-20 -66.07 -33.55 76.04 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.445 -0.784 . . . . 0.0 109.456 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -85.2 -39.73 17.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.662 -0.649 . . . . 0.0 109.543 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.12 -41.67 90.21 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -69.98 -34.63 73.61 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -58.76 -34.97 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.71 61.88 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.57 -0.706 . . . . 0.0 109.519 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.71 -34.12 77.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.519 -0.738 . . . . 0.0 109.943 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.77 -37.2 41.64 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.411 -0.805 . . . . 0.0 110.071 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.7 tpp -81.15 -25.95 36.46 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.286 -0.884 . . . . 0.0 109.79 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -71.97 -56.41 5.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.414 -0.804 . . . . 0.0 109.82 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 27.3 mtm -62.99 -27.21 69.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.491 -0.756 . . . . 0.0 109.97 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.3 t -74.22 -28.63 61.34 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.031 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.3 mp -109.81 21.57 16.73 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.427 -0.796 . . . . 0.0 110.192 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -107.05 -38.92 5.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.282 -0.886 . . . . 0.0 110.27 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -163.06 102.15 0.2 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -159.83 108.02 1.73 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.381 -1.07 . . . . 0.0 110.33 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.16 -14.45 14.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.308 -0.87 . . . . 0.0 110.453 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -25.48 66.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.187 -0.945 . . . . 0.0 110.081 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.95 97.6 0.16 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.75 77.89 1.79 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.317 -1.108 . . . . 0.0 110.157 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -135.17 61.38 1.67 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.371 -0.83 . . . . 0.0 110.237 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.23 38.51 2.73 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.355 -0.841 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.8 p -140.4 -65.75 0.45 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.288 -0.882 . . . . 0.0 110.266 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.191 -179.989 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.444 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 39.3 ttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.339 0.59 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -120.44 139.17 53.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.486 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 45.0 pt -137.55 158.33 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.223 -0.923 . . . . 0.0 110.514 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -111.78 145.56 39.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.608 -0.683 . . . . 0.0 110.297 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 60.7 t -128.18 122.63 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.373 -0.829 . . . . 0.0 109.844 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.13 135.9 40.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.358 -0.839 . . . . 0.0 110.182 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.2 p -95.67 171.52 8.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.39 -0.819 . . . . 0.0 110.583 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.437 ' N ' ' CD2' ' B' ' 8' ' ' LEU . 4.5 mm? -61.26 -13.28 17.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.506 -0.746 . . . . 0.0 111.192 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 75.8 p -95.44 -21.06 18.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.119 -0.988 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.89 9.2 14.16 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.941 -1.123 . . . . 0.0 110.394 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 131.76 34.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.071 -1.252 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -113.02 122.24 47.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.121 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mt -109.11 137.0 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.401 -0.812 . . . . 0.0 110.335 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.1 m -102.11 122.14 43.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 82.5 mt -123.44 161.45 24.78 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.171 -0.955 . . . . 0.0 110.806 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -106.25 116.12 31.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.534 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.444 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.9 m -140.03 179.12 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.336 -0.853 . . . . 0.0 110.627 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -113.12 165.18 13.75 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.495 -0.753 . . . . 0.0 109.29 178.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.51 -27.59 15.49 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.593 1.312 . . . . 0.0 110.338 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.44 -2.34 57.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.214 -0.928 . . . . 0.0 110.494 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -71.21 143.27 50.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.23 -0.919 . . . . 0.0 110.44 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 82.5 p -83.22 160.33 21.8 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.513 -0.742 . . . . 0.0 110.261 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.444 HD11 HG23 ' B' ' 23' ' ' ILE . 48.4 mm -59.83 -38.16 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.41 -33.43 72.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 109.365 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -70.32 -35.27 73.54 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.537 -0.727 . . . . 0.0 109.217 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.65 -37.17 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.458 -0.776 . . . . 0.0 108.926 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -63.08 -42.16 99.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.445 -0.784 . . . . 0.0 108.922 178.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.19 75.1 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.606 -0.684 . . . . 0.0 109.325 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -68.35 -38.55 81.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.464 -0.773 . . . . 0.0 109.633 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.9 mt -67.26 -40.93 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 109.223 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -48.68 80.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.421 -0.8 . . . . 0.0 109.497 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.89 -28.03 63.84 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.505 -0.747 . . . . 0.0 110.206 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -83.53 -42.66 16.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 110.146 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -108.33 -118.18 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.444 -0.785 . . . . 0.0 109.743 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.8 23.93 0.22 Allowed Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.783 -1.199 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 81.7 mt -91.88 142.2 26.26 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.205 -1.173 . . . . 0.0 110.21 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.43 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.5 Cg_endo -69.48 134.15 27.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.698 1.367 . . . . 0.0 110.269 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.74 -26.32 82.77 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.717 1.377 . . . . 0.0 110.84 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.79 -24.98 64.48 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.305 -0.872 . . . . 0.0 109.941 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 30.9 mt-30 -101.27 7.38 42.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 110.514 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -94.38 138.05 32.8 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.483 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 2.7 ttm180 -130.32 127.81 40.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.449 -0.782 . . . . 0.0 109.627 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -104.49 125.01 50.28 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.35 -0.844 . . . . 0.0 110.609 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.42 ' O ' ' CD2' ' B' ' 68' ' ' HIS . 1.6 mt -122.25 141.11 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.566 -0.709 . . . . 0.0 110.31 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.431 ' CD1' HD11 ' B' ' 67' ' ' LEU . 47.1 t80 -141.65 148.2 38.76 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.25 0.3 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.511 -0.743 . . . . 0.0 111.482 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.21 1.99 90.27 Favored Glycine 0 N--CA 1.495 2.617 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.743 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -110.8 141.89 43.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.924 -1.339 . . . . 0.0 110.296 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -78.35 132.54 37.45 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 109.784 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.453 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 17.9 mt -84.05 142.79 30.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.232 -0.917 . . . . 0.0 110.08 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -93.45 132.75 37.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.358 -0.839 . . . . 0.0 110.406 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -48.42 -30.45 5.08 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.55 -0.719 . . . . 0.0 111.019 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.81 -2.66 90.67 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.54 153.73 18.81 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.101 -1.235 . . . . 0.0 110.343 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.8 p -102.19 164.18 11.83 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.85 . . . . 0.0 110.103 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -53.58 -47.3 70.25 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.297 -0.877 . . . . 0.0 110.683 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 17.8 p -56.8 -36.04 69.45 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.396 -0.815 . . . . 0.0 111.214 -179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.44 -28.91 67.4 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.124 -0.985 . . . . 0.0 110.403 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.453 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 35.9 m-85 -101.19 28.32 5.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.419 -0.8 . . . . 0.0 109.908 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 50.77 28.45 3.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.596 -0.69 . . . . 0.0 110.669 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.452 HD13 HG22 ' B' ' 61' ' ' ILE . 92.4 mt -81.4 108.88 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.253 -0.904 . . . . 0.0 109.764 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -105.45 173.28 6.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.388 -0.82 . . . . 0.0 110.348 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.3 ptmt -46.76 152.77 0.45 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.504 -0.748 . . . . 0.0 111.085 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 63.17 14.98 8.17 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.805 -0.559 . . . . 0.0 111.012 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -71.5 145.25 49.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.012 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.5 m -107.6 109.8 21.53 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.416 -0.803 . . . . 0.0 109.987 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.468 ' N ' ' CD2' ' B' ' 67' ' ' LEU . 2.9 mm? -102.47 160.53 14.47 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.309 -0.87 . . . . 0.0 110.134 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' B' ' 44' ' ' ILE . 9.1 m-70 -108.64 134.62 51.13 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.3 -0.875 . . . . 0.0 109.688 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 35.8 tp -107.15 127.57 53.62 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 110.129 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 44.2 t -124.87 165.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.435 -0.791 . . . . 0.0 110.02 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 74.5 mt -93.94 109.44 21.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -84.67 117.32 23.71 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 7.8 mt -79.13 126.38 30.65 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.363 -0.836 . . . . 0.0 110.25 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -102.8 107.88 18.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.349 -0.845 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.94 -45.94 0.04 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 CA-C-O 117.979 -1.456 . . . . 0.0 109.552 -179.928 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.845 0 CA-C-O 121.201 0.524 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.592 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 3.2 tmm? -74.76 -17.74 60.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.592 ' CB ' ' O ' ' A' ' 2' ' ' MET . 0.2 OUTLIER 82.45 38.14 0.05 Allowed 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -179.031 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.51 -51.75 2.29 Favored Glycine 0 N--CA 1.482 1.755 0 N-CA-C 109.697 -1.361 . . . . 0.0 109.697 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.33 70.94 2.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.42 -1.047 . . . . 0.0 110.308 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -133.72 -64.82 0.07 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.45 22.42 1.32 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.371 -1.076 . . . . 0.0 110.354 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.42 -31.54 3.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 110.439 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -41.75 88.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.287 -0.883 . . . . 0.0 110.314 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -93.3 87.09 5.51 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.449 -0.782 . . . . 0.0 110.182 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -114.28 63.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.44 -0.788 . . . . 0.0 109.919 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 58.48 25.67 13.3 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.341 -0.849 . . . . 0.0 110.176 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -100.94 -12.93 35.51 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.6 t -61.98 -67.36 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.283 -1.128 . . . . 0.0 110.129 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -137.42 163.08 51.31 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.344 -0.847 . . . . 0.0 110.436 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.73 -19.39 27.68 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 O-C-N 123.828 1.436 . . . . 0.0 110.67 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.5 t -67.93 -12.43 60.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.36 -20.22 60.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.197 -0.94 . . . . 0.0 110.551 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.51 121.2 0.62 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.175 -0.953 . . . . 0.0 109.829 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -69.7 -15.36 37.28 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 123.957 1.504 . . . . 0.0 110.234 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.44 -31.64 57.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.839 . . . . 0.0 109.302 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.6 mt -85.32 -29.38 24.57 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.458 -0.776 . . . . 0.0 109.081 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.29 -32.62 68.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.545 -0.722 . . . . 0.0 109.295 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.39 -37.32 25.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.575 -0.703 . . . . 0.0 109.524 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.58 -35.5 77.46 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.375 -0.828 . . . . 0.0 109.87 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.407 ' CD1' ' O ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -80.58 -23.54 39.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.454 -0.778 . . . . 0.0 110.137 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.53 -33.54 25.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.209 -0.932 . . . . 0.0 109.588 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.6 t -75.86 -41.8 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.519 -0.738 . . . . 0.0 109.642 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 m -70.91 -40.11 72.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.61 -42.8 93.44 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.37 -0.831 . . . . 0.0 109.976 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -64.25 -32.1 73.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 109.913 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -64.42 -51.14 64.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.388 -0.82 . . . . 0.0 109.92 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -60.56 -36.38 78.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.388 -0.82 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -36.73 84.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.399 -0.813 . . . . 0.0 109.744 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -62.69 -43.73 98.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.422 -0.799 . . . . 0.0 109.831 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -70.11 -37.14 75.28 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.377 -0.827 . . . . 0.0 109.81 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.444 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -70.84 -26.56 63.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.5 -0.75 . . . . 0.0 109.933 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.39 -57.23 3.94 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.518 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.56 -31.65 37.07 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.371 -0.83 . . . . 0.0 109.023 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -85.33 -37.49 19.88 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.444 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -65.93 -55.79 15.08 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.752 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -61.93 -31.65 71.99 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.426 -0.797 . . . . 0.0 109.986 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -40.51 81.2 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.33 -0.856 . . . . 0.0 109.899 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -36.16 68.41 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 109.812 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.9 -31.15 71.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.465 -0.772 . . . . 0.0 109.919 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.69 -36.18 65.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.428 -0.795 . . . . 0.0 110.081 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.78 60.13 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.211 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -43.66 61.11 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.395 -0.815 . . . . 0.0 110.139 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.98 74.57 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.455 -0.778 . . . . 0.0 110.148 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.2 -25.81 55.5 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.78 -37.96 83.66 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.299 -0.875 . . . . 0.0 110.098 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -97.97 -28.4 13.81 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.838 . . . . 0.0 110.133 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.06 20.7 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.4 mm -107.77 90.42 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.391 -1.064 . . . . 0.0 109.999 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -151.63 76.47 1.2 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.862 . . . . 0.0 110.256 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -149.89 152.16 34.62 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.342 -0.849 . . . . 0.0 110.195 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.1 m -117.61 102.55 9.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.164 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -140.05 -91.35 0.2 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -155.26 75.26 0.94 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.374 -1.074 . . . . 0.0 110.214 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -133.29 85.45 2.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.283 -0.885 . . . . 0.0 110.244 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.25 -42.84 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.382 -0.824 . . . . 0.0 110.228 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.08 76.13 1.51 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.339 -0.851 . . . . 0.0 110.074 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -76.66 -40.0 50.4 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.356 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -78.52 -32.28 47.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.212 -0.93 . . . . 0.0 109.131 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.79 -44.67 96.51 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.823 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.43 -29.56 70.61 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.2 tt -75.49 -37.92 59.85 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.518 -0.739 . . . . 0.0 109.785 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -55.43 4.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 110.476 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 ttt -52.87 -41.61 64.47 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 110.687 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 83.7 m -69.01 -40.85 78.43 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.315 -0.866 . . . . 0.0 110.508 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.1 tp -80.07 -18.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.959 . . . . 0.0 109.858 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.93 -38.24 69.89 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.324 -0.86 . . . . 0.0 109.535 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -79.21 -31.78 43.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.461 -0.775 . . . . 0.0 109.673 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -80.13 -51.54 8.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.451 -0.781 . . . . 0.0 109.865 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.28 -23.69 66.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.371 -0.831 . . . . 0.0 110.122 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.4 107.22 0.17 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.332 -0.855 . . . . 0.0 110.497 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.26 -49.85 0.24 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.391 -1.483 . . . . 0.0 109.391 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -105.33 113.52 27.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.466 -1.02 . . . . 0.0 109.989 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -140.28 34.3 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.29 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -100.69 34.84 5.27 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.401 ' C ' ' H ' ' A' ' 83' ' ' ASP . 0.4 OUTLIER -160.22 145.16 11.02 Favored Pre-proline 0 N--CA 1.485 1.318 0 O-C-N 121.428 -1.042 . . . . 0.0 108.723 179.782 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -76.0 38.49 0.59 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.455 1.239 . . . . 0.0 110.762 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.401 ' H ' ' C ' ' A' ' 81' ' ' LEU . 0.9 OUTLIER 50.4 91.81 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.179 -0.95 . . . . 0.0 110.701 -179.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.51 -24.79 15.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.357 -0.839 . . . . 0.0 110.202 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.41 -27.72 67.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.313 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.4 t -91.2 -24.85 19.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.311 -0.868 . . . . 0.0 110.324 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 32.0 mtt -67.41 117.53 9.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.402 -0.811 . . . . 0.0 110.324 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.2 p -79.37 -163.33 0.49 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.408 -0.807 . . . . 0.0 110.377 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.533 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 9.6 pt-20 -67.71 -32.23 72.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.468 -0.77 . . . . 0.0 109.258 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -85.35 -39.74 17.3 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.81 -44.78 92.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.13 -35.7 81.19 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.533 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.37 -33.79 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 178.856 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.76 -48.64 78.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 109.875 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -38.52 65.62 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.42 -0.8 . . . . 0.0 109.698 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.2 -37.89 86.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.446 -0.784 . . . . 0.0 109.992 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.5 ttm -80.66 -26.96 37.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.357 -0.839 . . . . 0.0 109.704 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -33.57 75.91 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.498 -0.751 . . . . 0.0 109.877 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.7 mtt -86.27 -28.92 23.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 110.097 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -28.89 55.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.405 -0.809 . . . . 0.0 110.148 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.8 tp -85.16 5.33 30.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -65.38 -29.33 70.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.23 -0.919 . . . . 0.0 110.244 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.1 121.51 3.1 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -92.63 78.99 4.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.409 -1.054 . . . . 0.0 110.227 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -65.42 -44.26 87.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -91.08 -67.53 0.85 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.312 -0.868 . . . . 0.0 110.185 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.11 -58.09 5.02 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -82.36 67.07 8.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.322 -1.105 . . . . 0.0 110.184 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.32 42.84 2.31 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.378 -0.826 . . . . 0.0 110.171 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -73.87 -34.96 64.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.406 -0.809 . . . . 0.0 110.152 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 t -105.69 41.66 1.35 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.21 -179.993 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.6 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.164 0.507 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -90.51 139.45 30.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.439 -0.788 . . . . 0.0 109.843 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -137.25 158.43 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.264 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.41 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 82.6 m-85 -111.77 145.11 39.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.646 . . . . 0.0 110.671 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.7 t -128.03 119.44 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 109.53 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mtmp? -100.26 129.85 46.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.361 -0.837 . . . . 0.0 110.686 -179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.2 p -96.4 174.81 6.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.437 -0.79 . . . . 0.0 110.067 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mt -61.62 -13.56 23.21 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.312 -0.868 . . . . 0.0 110.841 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 79.0 p -95.57 19.02 11.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.106 -0.997 . . . . 0.0 110.565 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.88 11.57 58.24 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.84 128.28 34.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.068 -1.254 . . . . 0.0 109.952 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.4 m -113.09 124.43 52.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.883 . . . . 0.0 110.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.472 HG22 HD11 ' B' ' 13' ' ' ILE . 22.0 mt -109.14 136.88 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.48 -0.762 . . . . 0.0 110.288 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.41 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 12.0 m -102.29 120.78 41.06 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.529 -0.732 . . . . 0.0 109.502 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 69.8 mt -123.38 162.93 21.8 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 110.963 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.3 115.71 30.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.537 -0.727 . . . . 0.0 109.347 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.424 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.25 174.85 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.285 -0.885 . . . . 0.0 110.863 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -113.14 165.5 13.08 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.41 -24.98 22.01 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 123.507 1.267 . . . . 0.0 110.385 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.0 p -84.6 -4.62 59.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 110.474 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -71.26 139.11 49.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.175 -0.953 . . . . 0.0 110.683 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.556 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 57.6 p -83.67 160.21 21.38 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.51 -0.744 . . . . 0.0 110.495 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.445 HG12 ' HB3' ' B' ' 50' ' ' LEU . 1.7 mp -59.48 -34.88 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.346 -0.846 . . . . 0.0 109.705 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.31 -37.26 80.02 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.371 -0.83 . . . . 0.0 109.386 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -31.48 68.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.463 -0.773 . . . . 0.0 109.203 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.1 t -69.92 -41.64 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.515 -0.741 . . . . 0.0 109.078 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -62.88 -38.95 92.94 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.437 -0.789 . . . . 0.0 108.947 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.79 -36.18 80.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.488 -0.757 . . . . 0.0 109.346 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -68.28 -39.7 82.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 12.5 mt -66.92 -38.87 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.211 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.67 -50.63 72.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.476 -0.765 . . . . 0.0 109.578 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.87 -26.42 62.09 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.401 -0.812 . . . . 0.0 110.236 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -84.27 -40.46 17.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.807 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.99 -55.54 2.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.441 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.19 17.76 1.96 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.405 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 81.1 mt -91.45 144.52 29.78 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.157 -1.202 . . . . 0.0 109.791 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.418 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.9 Cg_endo -70.13 133.48 24.99 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.552 1.291 . . . . 0.0 110.417 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.97 -27.48 84.85 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.736 1.387 . . . . 0.0 111.046 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.83 -22.39 64.24 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.396 -0.815 . . . . 0.0 110.336 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.418 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 41.9 mm-40 -101.29 -2.29 31.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.313 -0.867 . . . . 0.0 110.646 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -94.35 143.42 26.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.215 -0.928 . . . . 0.0 110.397 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -130.09 132.19 46.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.942 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 20.1 mt -104.74 119.54 39.25 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.355 -0.84 . . . . 0.0 110.369 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 2.0 mp -121.17 134.71 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.503 -0.748 . . . . 0.0 109.907 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.431 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 37.2 t80 -141.49 154.53 45.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.548 -0.72 . . . . 0.0 110.007 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.431 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.1 25.56 0.18 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.539 -0.725 . . . . 0.0 111.513 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.34 -4.93 75.14 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.777 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.77 142.84 42.21 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.04 -1.271 . . . . 0.0 110.47 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.71 138.4 38.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.351 -0.843 . . . . 0.0 109.779 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.445 ' HB3' HG12 ' B' ' 23' ' ' ILE . 40.7 mt -84.3 148.4 26.69 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.304 -0.872 . . . . 0.0 109.998 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -93.51 125.95 38.4 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.327 -0.858 . . . . 0.0 110.394 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -48.54 -32.49 8.08 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.362 -0.836 . . . . 0.0 110.984 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.69 -1.85 90.58 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 31.9 mmt-85 -99.57 157.88 16.14 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.066 -1.255 . . . . 0.0 110.29 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.556 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.5 p -102.55 162.22 13.09 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 93.7 mt -53.37 -45.38 69.17 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.279 -0.888 . . . . 0.0 110.649 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.87 -36.7 70.38 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.085 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.63 -27.69 66.56 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.187 -0.946 . . . . 0.0 110.361 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.43 ' CG ' HD22 ' B' ' 50' ' ' LEU . 36.9 m-85 -101.09 27.59 5.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.348 -0.845 . . . . 0.0 109.931 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 50.88 28.03 3.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.464 -0.773 . . . . 0.0 110.716 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.463 HD13 HG21 ' B' ' 61' ' ' ILE . 85.9 mt -81.43 112.04 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.349 -0.845 . . . . 0.0 109.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.63 173.02 6.49 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.38 -0.825 . . . . 0.0 110.448 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.8 pttm -46.65 154.16 0.33 Allowed 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.492 0.663 . . . . 0.0 111.177 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.4 mt-10 62.58 15.61 8.09 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.749 -0.594 . . . . 0.0 110.805 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 141.57 49.9 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.179 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.8 m -107.61 110.63 22.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.292 -0.88 . . . . 0.0 109.945 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 mt -102.76 161.47 13.71 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.313 -0.867 . . . . 0.0 110.008 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -108.8 131.64 54.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.306 -0.871 . . . . 0.0 109.951 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 61.9 tp -106.98 133.85 51.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.217 -0.927 . . . . 0.0 110.551 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 45.1 t -124.96 154.39 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.35 -0.844 . . . . 0.0 110.205 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 43.4 mt -94.4 89.39 5.85 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.394 -0.817 . . . . 0.0 110.288 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -73.84 142.36 46.11 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.179 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 mt -125.53 -170.82 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.353 -0.842 . . . . 0.0 110.211 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -74.17 116.69 15.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.375 -0.828 . . . . 0.0 110.203 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.92 -31.5 35.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.869 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.9 t60 . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.171 0.51 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.573 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -77.94 -41.46 36.24 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 2' ' ' MET . 5.1 tp 80.91 39.45 0.07 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.69 -39.72 77.2 Favored Glycine 0 N--CA 1.481 1.689 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 52.39 89.82 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.343 -1.092 . . . . 0.0 110.426 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.26 -169.99 12.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.29 35.96 1.4 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.39 -1.065 . . . . 0.0 110.158 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.02 -37.02 2.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.372 -0.83 . . . . 0.0 110.345 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -55.69 -44.7 77.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.234 -0.916 . . . . 0.0 110.32 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -115.56 93.55 4.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.362 -0.836 . . . . 0.0 109.976 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.94 52.98 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.319 -0.863 . . . . 0.0 110.389 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 51.92 29.06 5.67 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.334 -0.854 . . . . 0.0 110.434 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -126.33 32.39 3.76 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.9 m -139.9 -41.1 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.355 -1.085 . . . . 0.0 110.463 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 17' ' ' SER . 28.9 p30 -139.26 163.87 42.79 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.201 -0.937 . . . . 0.0 109.826 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.48 ' HD2' ' HB2' ' A' ' 15' ' ' ASP . 35.3 Cg_endo -57.89 72.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.879 1.462 . . . . 0.0 111.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.2 p 63.2 33.42 14.32 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.585 0.707 . . . . 0.0 109.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 17' ' ' SER . . . 38.15 33.78 0.06 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.266 0.555 . . . . 0.0 111.264 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.84 118.47 0.54 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.45 -0.782 . . . . 0.0 109.884 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.44 -14.95 34.44 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 O-C-N 123.937 1.493 . . . . 0.0 110.199 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HG3' ' N ' ' A' ' 22' ' ' LEU . 9.9 pt-20 -76.57 -28.48 56.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.349 -0.845 . . . . 0.0 109.692 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.415 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 29.2 mt -90.59 -27.01 19.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.499 -0.75 . . . . 0.0 109.558 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.33 -35.03 71.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.366 -0.834 . . . . 0.0 109.648 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.2 mt -84.37 -31.23 24.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.358 -0.839 . . . . 0.0 109.567 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.97 75.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.473 -0.767 . . . . 0.0 109.764 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp -83.28 -23.14 32.77 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -81.6 -31.15 32.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.275 -0.891 . . . . 0.0 109.393 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 63.9 t -82.37 -25.33 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.613 -0.679 . . . . 0.0 109.814 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -80.03 -47.43 14.9 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 110.267 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 31.5 mtp -67.28 -31.09 71.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.413 -0.804 . . . . 0.0 110.281 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -73.04 -36.42 66.92 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.387 -0.821 . . . . 0.0 110.242 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -39.45 76.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.861 . . . . 0.0 110.017 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -66.35 -27.64 68.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.418 -0.801 . . . . 0.0 110.086 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -75.1 -47.11 30.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.329 -0.857 . . . . 0.0 110.176 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -59.86 -25.94 65.45 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.278 -0.889 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -83.06 -48.05 11.01 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.336 -0.853 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.459 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.5 mm-40 -75.74 -21.95 57.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.384 -0.822 . . . . 0.0 110.373 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -83.96 -57.4 3.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.294 -0.879 . . . . 0.0 109.73 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -52.58 -32.54 41.65 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.382 -0.824 . . . . 0.0 109.19 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -84.18 -36.63 22.7 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.598 -0.688 . . . . 0.0 109.673 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -70.53 -56.45 6.53 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.974 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -57.19 -42.52 81.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.47 -0.769 . . . . 0.0 110.384 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.6 ttm180 -57.23 -33.76 67.89 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.263 -0.898 . . . . 0.0 110.049 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.56 -27.87 61.56 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.379 -0.825 . . . . 0.0 109.826 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.63 -24.74 56.48 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.462 -0.774 . . . . 0.0 110.081 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.23 -44.96 11.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.337 -0.852 . . . . 0.0 110.205 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.64 -35.96 82.31 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.371 -0.83 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 t -77.68 -30.92 52.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.436 -0.79 . . . . 0.0 110.273 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.92 -32.32 61.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.219 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.78 -27.72 50.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 110.283 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -68.25 -27.7 66.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.286 -0.884 . . . . 0.0 110.286 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.09 -28.16 15.23 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.246 -0.909 . . . . 0.0 110.263 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -92.76 -49.85 2.63 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.415 HG21 HD11 ' A' ' 54' ' ' ILE . 36.0 mm -117.18 96.71 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.323 -1.104 . . . . 0.0 110.159 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -167.88 -62.94 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.459 -0.775 . . . . 0.0 110.258 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.2 p -121.19 108.59 13.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 110.199 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.4 m -133.85 -53.96 0.87 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.247 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.93 50.96 0.27 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.0 m -130.08 102.39 6.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.382 -1.069 . . . . 0.0 110.268 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -132.21 61.26 1.66 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 110.244 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.26 -34.57 11.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.39 -0.818 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.51 75.9 1.15 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.329 -0.857 . . . . 0.0 110.23 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -59.14 2.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 110.191 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -74.77 -27.5 60.36 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.215 -0.928 . . . . 0.0 109.175 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -43.84 97.88 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.874 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.95 -29.15 69.5 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -77.42 -36.84 52.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.529 -0.732 . . . . 0.0 109.866 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -84.3 -54.77 4.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.399 -0.813 . . . . 0.0 110.499 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.7 mmt -54.44 -43.05 71.25 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.148 -0.97 . . . . 0.0 110.627 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.5 m -69.62 -40.4 76.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.272 -0.892 . . . . 0.0 110.621 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 tp -82.17 -15.96 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.154 -0.966 . . . . 0.0 110.221 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 68' ' ' LYS . 27.5 t -74.77 -42.89 57.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.876 . . . . 0.0 109.791 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -79.25 -27.02 42.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.528 -0.733 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -83.14 -50.16 8.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.389 -0.819 . . . . 0.0 110.017 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.59 -33.35 72.6 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.372 -0.83 . . . . 0.0 110.049 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -63.63 -31.01 72.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.429 -0.794 . . . . 0.0 110.25 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.34 -27.96 71.55 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 132.95 40.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.344 -1.092 . . . . 0.0 110.263 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.8 m -151.28 27.36 0.68 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.292 -0.88 . . . . 0.0 110.181 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -88.35 54.78 4.21 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.0 149.2 1.46 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.425 -1.044 . . . . 0.0 108.856 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -71.03 64.64 2.56 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.59 1.31 . . . . 0.0 110.29 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -56.4 111.01 0.87 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.481 -0.762 . . . . 0.0 110.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 mt -80.05 -26.3 39.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.409 -0.807 . . . . 0.0 110.286 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.4 p -68.0 -15.66 63.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.312 -0.867 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.9 m -118.2 22.06 12.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 110.09 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 43.2 mtt -128.88 123.4 32.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.393 -0.817 . . . . 0.0 109.98 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.8 p -77.5 -163.08 0.35 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.423 -0.798 . . . . 0.0 110.401 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.553 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.3 pt-20 -68.52 -31.68 71.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.521 -0.737 . . . . 0.0 109.196 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.4 mt-10 -85.57 -40.04 16.72 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.25 -44.73 94.32 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -67.35 -34.18 76.78 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.553 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -66.38 -34.86 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.938 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.73 -46.0 90.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.514 -0.741 . . . . 0.0 110.238 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -40.19 29.87 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.367 -0.833 . . . . 0.0 109.949 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.91 79.21 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.349 -0.844 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 tpp -83.88 -24.39 30.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.361 -0.837 . . . . 0.0 110.097 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -28.62 66.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.298 -0.876 . . . . 0.0 110.228 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.8 mmm -93.96 -27.34 16.4 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.381 -0.824 . . . . 0.0 110.166 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -33.11 64.94 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.315 -0.866 . . . . 0.0 110.202 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.7 mt -72.08 -27.06 62.42 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.848 . . . . 0.0 110.206 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -104.91 14.0 30.19 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.37 -0.831 . . . . 0.0 110.489 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -138.7 78.81 0.3 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -84.08 79.34 9.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.377 -1.072 . . . . 0.0 110.176 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -101.75 -32.22 10.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.357 -0.839 . . . . 0.0 110.134 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.403 ' O ' ' CG ' ' A' ' 106' ' ' PHE . 59.2 t80 -113.84 35.65 4.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.357 -0.84 . . . . 0.0 110.157 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.12 133.58 36.64 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -83.42 64.59 7.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.3 -1.118 . . . . 0.0 110.177 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -92.49 -37.87 12.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.354 -0.841 . . . . 0.0 110.303 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.48 62.89 2.53 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.357 -0.839 . . . . 0.0 110.26 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.7 t -116.21 81.0 1.54 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.357 -0.84 . . . . 0.0 110.192 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.192 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.333 0.587 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -98.2 147.6 24.44 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.136 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 34.7 pt -137.63 157.72 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.334 -0.854 . . . . 0.0 110.076 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.41 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 80.5 m-85 -111.94 143.08 43.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.588 -0.695 . . . . 0.0 110.663 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 95.7 t -127.83 119.74 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.49 -0.756 . . . . 0.0 109.455 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 18.7 mttt -100.08 136.75 39.5 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.409 -0.807 . . . . 0.0 110.743 -179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 73.4 p -96.17 171.13 8.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.437 -0.789 . . . . 0.0 110.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.82 -10.49 9.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.397 -0.814 . . . . 0.0 111.24 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.5 p -95.55 -18.49 20.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.933 -1.105 . . . . 0.0 110.631 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.99 7.4 25.23 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -84.61 129.87 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.083 -1.245 . . . . 0.0 109.811 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.5 m -113.14 126.1 55.07 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.232 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.4 mt -109.23 136.21 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.432 -0.792 . . . . 0.0 110.489 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.41 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 19.2 m -102.41 119.78 39.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.457 -0.777 . . . . 0.0 109.409 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.3 mt -123.51 166.85 14.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -106.52 114.31 28.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.804 . . . . 0.0 109.48 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 33.8 m -140.52 169.34 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 110.951 -179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.61 165.12 13.72 Favored Pre-proline 0 N--CA 1.488 1.474 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -71.67 -24.73 21.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.466 1.245 . . . . 0.0 110.375 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.45 -5.67 59.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 110.531 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -71.24 143.48 50.4 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.265 -0.897 . . . . 0.0 110.721 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.534 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.4 p -83.3 159.52 21.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.588 -0.695 . . . . 0.0 110.391 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.415 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.5 mm -59.64 -36.33 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 109.647 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.83 -35.91 77.73 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 109.424 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -70.29 -33.15 71.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.538 -0.726 . . . . 0.0 109.393 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.1 t -70.15 -39.74 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.172 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -62.86 -43.49 98.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.475 -0.766 . . . . 0.0 109.166 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.35 -32.98 72.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.509 -0.744 . . . . 0.0 109.309 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 34.9 mttm -68.28 -39.36 82.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.479 -0.763 . . . . 0.0 109.473 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.26 -38.69 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.369 -0.832 . . . . 0.0 109.09 179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.5 OUTLIER -60.53 -50.67 72.64 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.491 179.108 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.19 -26.7 63.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.404 -0.81 . . . . 0.0 110.33 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.9 mmtm -83.85 -40.91 18.08 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.287 -0.883 . . . . 0.0 110.801 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -108.08 -55.57 2.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.244 -0.91 . . . . 0.0 110.449 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.36 18.59 1.82 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.407 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 18.3 mt -91.31 143.52 28.4 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.071 -1.252 . . . . 0.0 109.69 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.416 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.1 Cg_endo -68.0 133.84 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 O-C-N 123.65 1.342 . . . . 0.0 110.387 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.91 -26.48 83.19 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.65 1.342 . . . . 0.0 110.756 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.0 64.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.325 -0.86 . . . . 0.0 110.061 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.416 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 23.1 mt-30 -101.23 -0.9 35.01 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.37 -0.831 . . . . 0.0 110.629 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -94.17 140.39 29.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.163 -0.96 . . . . 0.0 110.243 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -130.08 130.43 44.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.457 -0.777 . . . . 0.0 109.956 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 23.1 mt -104.59 116.91 32.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.404 -0.81 . . . . 0.0 110.441 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 1.7 mp -121.16 134.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.493 -0.754 . . . . 0.0 109.862 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.425 ' CD2' HD23 ' B' ' 67' ' ' LEU . 57.5 t80 -140.8 152.5 45.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.469 -0.77 . . . . 0.0 109.941 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.18 27.76 0.35 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.492 -0.755 . . . . 0.0 111.25 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.03 1.64 80.09 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -110.79 137.27 48.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.044 -1.268 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -78.6 135.72 37.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.358 -0.838 . . . . 0.0 109.9 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.436 HD21 ' CE2' ' B' ' 59' ' ' TYR . 51.3 mt -83.83 138.4 33.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.384 -0.822 . . . . 0.0 110.123 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -93.64 131.02 39.34 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 110.422 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.415 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 64.3 m-20 -48.34 -27.6 2.65 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.484 -0.76 . . . . 0.0 111.059 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -7.98 86.47 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.2 mmt-85 -99.36 155.87 17.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.007 -1.29 . . . . 0.0 110.442 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.534 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.9 p -102.51 163.47 12.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.419 -0.8 . . . . 0.0 110.185 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 98.0 mt -53.49 -44.48 69.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.338 -0.851 . . . . 0.0 110.635 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 60.0 p -56.94 -36.85 70.73 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.333 -0.854 . . . . 0.0 110.986 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.52 -27.68 66.4 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.173 -0.955 . . . . 0.0 110.257 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.436 ' CE2' HD21 ' B' ' 50' ' ' LEU . 58.2 m-85 -100.95 27.74 5.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -0.809 . . . . 0.0 109.803 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 m120 50.74 28.33 3.54 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.544 -0.723 . . . . 0.0 110.673 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.454 HD11 HG21 ' B' ' 61' ' ' ILE . 88.5 mt -81.56 108.64 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.403 -0.811 . . . . 0.0 109.96 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.65 173.35 6.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.358 -0.839 . . . . 0.0 110.197 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -46.6 152.71 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.462 -0.774 . . . . 0.0 110.958 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 62.67 16.49 8.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.593 -0.692 . . . . 0.0 110.555 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.58 144.97 49.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.259 -0.901 . . . . 0.0 110.117 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.9 m -107.54 107.9 18.95 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.856 . . . . 0.0 109.919 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.425 HD23 ' CD2' ' B' ' 45' ' ' PHE . 4.3 mt -102.39 160.62 14.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.116 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -108.83 134.49 51.45 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.293 -0.88 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.8 tp -107.21 133.73 51.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.246 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 41.4 t -125.04 152.55 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.443 -0.786 . . . . 0.0 110.293 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mt -94.46 114.83 26.9 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.503 -0.748 . . . . 0.0 110.128 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -83.77 78.29 9.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.288 -0.883 . . . . 0.0 110.17 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -99.8 129.78 45.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.403 -0.811 . . . . 0.0 110.24 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -138.35 69.9 1.38 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.333 -0.854 . . . . 0.0 110.172 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 147.14 84.27 0.05 OUTLIER Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.011 -1.438 . . . . 0.0 109.621 -179.913 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.182 0.515 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.567 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -160.69 -65.31 0.06 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 110.198 -179.948 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.567 ' CB ' ' O ' ' A' ' 2' ' ' MET . 5.1 tp 80.66 39.93 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.91 60.73 3.78 Favored Glycine 0 N--CA 1.482 1.766 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -168.23 31.13 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.316 -1.109 . . . . 0.0 110.231 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.32 -55.28 0.26 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.59 26.95 9.5 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.362 -1.081 . . . . 0.0 110.159 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 75.6 m -129.42 17.85 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.412 -0.805 . . . . 0.0 110.4 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -103.42 -18.0 15.0 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.283 -0.885 . . . . 0.0 110.306 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE1' ' NH2' ' B' ' 72' ' ' ARG . 29.0 m-85 -101.68 -27.87 12.81 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.272 -0.893 . . . . 0.0 110.202 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.39 38.24 1.45 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.406 -0.808 . . . . 0.0 110.199 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.91 -44.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.372 -0.83 . . . . 0.0 110.164 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.94 -38.03 60.33 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.411 HG23 ' N ' ' A' ' 15' ' ' ASP . 31.7 m -114.89 -27.54 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.346 -1.091 . . . . 0.0 110.313 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.411 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.5 OUTLIER 58.85 173.01 0.05 OUTLIER Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.932 . . . . 0.0 109.945 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.91 -19.24 40.53 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 O-C-N 123.653 1.343 . . . . 0.0 110.412 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.0 t -73.62 -13.98 61.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.406 -0.808 . . . . 0.0 110.391 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.407 ' CB ' ' O ' ' A' ' 14' ' ' VAL . . . -92.82 -13.15 29.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.221 -0.924 . . . . 0.0 110.455 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -147.79 110.49 3.84 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.894 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -71.22 -9.52 25.59 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.02 1.537 . . . . 0.0 110.631 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -79.49 -31.64 42.33 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 109.116 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.3 tt -88.47 -28.21 20.99 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.531 -0.731 . . . . 0.0 109.346 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.36 -34.68 28.35 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 109.565 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.88 -32.49 74.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.374 -0.829 . . . . 0.0 109.7 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -82.99 -25.67 32.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.484 -0.76 . . . . 0.0 110.064 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -84.43 -33.29 23.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.88 . . . . 0.0 109.642 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 96.4 t -75.31 -30.84 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.554 -0.716 . . . . 0.0 109.788 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.1 m -77.6 -38.15 48.77 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.396 -0.815 . . . . 0.0 110.051 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.0 tpt -63.49 -46.55 85.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.442 -0.786 . . . . 0.0 110.005 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.84 -34.44 78.16 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.335 -0.853 . . . . 0.0 110.124 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.58 -45.81 88.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.276 -0.89 . . . . 0.0 109.959 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -62.04 -28.56 69.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.408 -0.807 . . . . 0.0 110.148 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -47.68 32.69 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.119 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.55 -47.11 80.16 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.474 -0.766 . . . . 0.0 110.134 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -49.47 75.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.365 -0.834 . . . . 0.0 110.101 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.426 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.5 mt-30 -69.42 -22.48 63.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.343 -0.848 . . . . 0.0 110.225 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.54 -57.43 3.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 109.666 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -52.36 -30.2 27.64 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.794 . . . . 0.0 109.202 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -88.03 -34.17 18.09 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.426 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -65.21 -47.52 76.6 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.358 -0.839 . . . . 0.0 109.729 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.5 ptt180 -70.53 -34.17 71.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.469 -0.769 . . . . 0.0 109.796 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mmt-85 -52.86 -42.8 65.57 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.39 -0.819 . . . . 0.0 109.219 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.9 -27.15 36.36 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.55 -28.51 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.562 -0.711 . . . . 0.0 109.739 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.67 -42.12 12.19 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.788 . . . . 0.0 110.049 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.09 -25.76 66.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.419 -0.8 . . . . 0.0 110.179 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.2 m -94.38 -32.62 13.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.346 -0.846 . . . . 0.0 110.236 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.92 -30.27 69.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.393 -0.817 . . . . 0.0 110.15 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.05 65.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.396 -0.815 . . . . 0.0 110.337 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -111.25 -34.69 6.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -0.882 . . . . 0.0 110.254 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -94.07 -37.29 11.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.354 -0.841 . . . . 0.0 110.213 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.36 -75.62 1.05 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 pt -125.84 -140.15 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.401 -1.058 . . . . 0.0 109.822 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.95 -175.5 4.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.091 -1.006 . . . . 0.0 110.21 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 m -143.46 151.23 40.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.411 -0.806 . . . . 0.0 110.209 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.2 t -143.34 82.77 1.76 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.377 -0.827 . . . . 0.0 110.16 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -134.64 27.79 3.18 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.6 m -106.86 55.38 0.66 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.344 -1.092 . . . . 0.0 110.139 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -83.74 80.59 9.08 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.56 -27.4 8.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.353 -0.842 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.22 77.74 1.66 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.822 . . . . 0.0 110.17 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.89 -53.04 7.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.369 -0.832 . . . . 0.0 110.229 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -74.34 -29.07 61.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.19 -0.944 . . . . 0.0 109.086 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.41 96.9 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.54 -0.864 . . . . 0.0 108.928 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 17.1 mt -64.73 -28.85 69.87 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.11 -47.54 28.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.522 -0.736 . . . . 0.0 109.842 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 -53.55 7.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.33 -0.856 . . . . 0.0 110.527 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -51.98 -39.6 59.59 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.177 -0.952 . . . . 0.0 110.714 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 34.3 m -69.2 -43.33 74.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.17 -12.65 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.136 -0.978 . . . . 0.0 110.332 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.53 -41.71 45.74 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.79 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -84.28 -23.02 30.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.416 -0.803 . . . . 0.0 110.249 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.47 -40.19 14.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.344 -0.848 . . . . 0.0 110.422 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -75.33 -29.57 60.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.197 -0.939 . . . . 0.0 110.243 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.401 ' CE1' ' OG1' ' A' ' 79' ' ' THR . 73.2 t80 -59.53 109.72 0.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.354 -0.841 . . . . 0.0 110.186 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -146.56 -67.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -92.0 -28.92 16.9 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -1.131 . . . . 0.0 110.312 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.401 ' OG1' ' CE1' ' A' ' 76' ' ' PHE . 90.7 m 52.45 28.99 6.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.393 -0.817 . . . . 0.0 110.338 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -92.73 24.88 21.68 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.4 ' C ' ' H ' ' A' ' 83' ' ' ASP . 0.4 OUTLIER -173.08 147.38 1.5 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.244 -1.15 . . . . 0.0 108.902 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -75.56 38.75 0.58 Allowed 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.506 1.266 . . . . 0.0 110.719 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' A' ' 81' ' ' LEU . 68.1 m-20 50.15 76.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.228 -0.92 . . . . 0.0 110.553 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.2 mt -79.32 -27.87 42.13 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.372 -0.83 . . . . 0.0 110.333 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -25.7 62.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.283 -0.886 . . . . 0.0 110.288 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.0 p -83.86 -37.57 22.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.358 -0.839 . . . . 0.0 110.106 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 15.0 mtm -81.44 121.05 25.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.384 -0.822 . . . . 0.0 110.139 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.6 p -77.54 -164.55 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.304 -0.872 . . . . 0.0 110.426 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.565 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.5 pt-20 -67.61 -30.99 70.72 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.558 -0.713 . . . . 0.0 109.126 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.412 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 65.6 mt-10 -85.31 -40.67 16.3 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.75 -42.16 99.54 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -70.47 -35.62 73.41 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.565 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.33 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.23 96.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.484 -0.76 . . . . 0.0 109.624 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -74.05 -51.82 14.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.495 -0.753 . . . . 0.0 110.147 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.92 -37.65 80.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.453 -0.779 . . . . 0.0 110.358 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 tpt -81.57 -20.13 40.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.103 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -69.34 -30.56 68.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.088 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 69.7 mtp -95.42 -21.84 18.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.35 -0.844 . . . . 0.0 110.473 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.4 m -79.64 -37.56 35.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.261 -0.899 . . . . 0.0 110.418 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.98 -35.23 78.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.273 -0.892 . . . . 0.0 110.182 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -84.37 -64.44 1.16 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 116.68 -95.71 0.69 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.539 -1.425 . . . . 0.0 109.539 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -165.87 112.92 0.91 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.378 -1.072 . . . . 0.0 110.242 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -125.73 33.35 5.11 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.302 -0.874 . . . . 0.0 110.257 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -147.68 -62.76 0.27 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.73 55.28 1.16 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -129.82 -149.48 0.4 Allowed 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.376 -1.073 . . . . 0.0 109.617 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -89.33 0.59 56.7 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.381 -0.825 . . . . 0.0 110.595 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 51.97 61.51 3.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.519 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.8 m -153.84 113.82 3.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.381 -0.824 . . . . 0.0 110.216 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.184 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.455 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.313 0.578 . . . . 0.0 110.349 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -119.08 137.9 53.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.512 -0.742 . . . . 0.0 109.508 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 40.1 pt -137.66 157.97 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -0.967 . . . . 0.0 110.626 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -111.91 146.85 37.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.604 -0.685 . . . . 0.0 110.364 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 66.3 t -127.78 116.55 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 109.598 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.0 136.85 39.29 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.545 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.7 p -96.02 168.3 10.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.444 -0.785 . . . . 0.0 110.063 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt -61.8 -8.84 5.34 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.315 -0.866 . . . . 0.0 111.29 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 47.7 p -95.43 -19.74 19.64 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.079 -1.013 . . . . 0.0 110.597 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.31 6.23 22.24 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 10.5 tttp -84.66 129.7 34.8 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.093 -1.239 . . . . 0.0 109.968 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.6 m -113.21 128.73 56.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.084 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 38.4 mt -109.28 141.19 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.504 -0.748 . . . . 0.0 110.406 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 27.6 m -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.366 -0.834 . . . . 0.0 109.176 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.414 ' CD2' ' CE ' ' B' ' 33' ' ' LYS . 35.0 mt -123.42 154.35 39.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.987 . . . . 0.0 111.137 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -106.32 114.98 29.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.443 -0.786 . . . . 0.0 109.034 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.455 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.4 m -140.01 176.76 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 111.039 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -113.19 166.87 10.22 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.88 -25.73 19.62 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 O-C-N 123.493 1.26 . . . . 0.0 110.192 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.82 -1.9 57.03 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.171 -0.956 . . . . 0.0 110.552 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -71.19 140.57 50.54 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.123 -0.986 . . . . 0.0 110.567 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.9 p -83.62 159.2 21.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 110.763 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.438 HG21 HD13 ' B' ' 23' ' ' ILE . 44.1 mm -59.71 -40.57 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.42 -0.8 . . . . 0.0 109.621 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -56.85 -34.58 67.95 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 109.579 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -70.59 -33.6 71.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.514 -0.741 . . . . 0.0 109.329 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 82.0 t -69.91 -40.22 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.415 -0.803 . . . . 0.0 109.186 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -62.86 -41.32 99.32 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.419 -0.801 . . . . 0.0 109.083 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.77 74.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.537 -0.727 . . . . 0.0 109.297 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -68.07 -40.5 82.71 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.535 -0.728 . . . . 0.0 109.555 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.402 HD11 HG21 ' B' ' 30' ' ' ILE . 36.8 mt -66.78 -37.34 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.312 -0.868 . . . . 0.0 109.115 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.55 -47.71 84.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.418 -0.801 . . . . 0.0 109.254 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.44 -31.67 67.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.508 -0.745 . . . . 0.0 110.613 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.414 ' CE ' ' CD2' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -83.42 -36.96 23.84 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.293 -0.879 . . . . 0.0 111.262 -179.312 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -108.11 -55.86 2.32 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.106 -0.996 . . . . 0.0 110.55 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 125.88 15.37 2.9 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 90.6 mt -91.25 142.95 27.63 Favored Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.154 -1.203 . . . . 0.0 109.749 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.488 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.6 Cg_endo -68.22 134.79 32.43 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.638 1.336 . . . . 0.0 110.622 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.91 -25.64 81.72 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 O-C-N 123.695 1.366 . . . . 0.0 111.012 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.68 -22.01 64.4 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 109.902 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.488 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.2 mp0 -101.01 -4.25 27.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.454 -0.779 . . . . 0.0 110.513 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -94.26 142.5 27.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.07 130.99 45.59 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.421 -0.799 . . . . 0.0 109.725 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 24.5 mt -104.64 118.72 37.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.244 -0.91 . . . . 0.0 110.448 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.402 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 1.9 mp -121.32 135.37 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.405 -0.81 . . . . 0.0 109.723 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.423 ' CD2' ' HB1' ' B' ' 46' ' ' ALA . 78.9 t80 -140.72 150.49 43.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.453 -0.779 . . . . 0.0 110.053 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.423 ' HB1' ' CD2' ' B' ' 45' ' ' PHE . . . 45.28 28.01 0.4 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.482 -0.761 . . . . 0.0 111.253 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.77 1.97 84.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 136.65 49.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.084 -1.245 . . . . 0.0 110.178 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -78.41 135.17 37.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.831 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.437 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 49.1 mt -83.79 140.72 31.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.296 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.58 131.27 39.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.346 -0.846 . . . . 0.0 110.418 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.42 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 76.7 m-20 -48.3 -32.43 7.34 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.438 -0.789 . . . . 0.0 111.051 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.07 -2.69 90.6 Favored Glycine 0 N--CA 1.493 2.492 0 C-N-CA 120.132 -1.032 . . . . 0.0 110.599 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.419 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.8 mmt85 -99.47 153.34 19.1 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.272 . . . . 0.0 110.445 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 82.6 p -102.2 164.63 11.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.451 -0.781 . . . . 0.0 110.174 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 mt -53.49 -44.82 69.35 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.28 -0.887 . . . . 0.0 110.743 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 42.3 t -56.62 -35.55 68.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.371 -0.831 . . . . 0.0 111.02 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -59.71 -28.98 67.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.296 -0.878 . . . . 0.0 110.407 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 64.3 m-85 -100.94 24.57 9.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.332 -0.855 . . . . 0.0 110.228 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 50.64 30.76 5.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.489 -0.757 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 86.1 mt -81.4 114.37 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.409 -0.807 . . . . 0.0 109.926 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -105.77 171.13 7.5 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.372 -0.83 . . . . 0.0 110.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.1 OUTLIER -46.62 155.11 0.26 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.548 -0.72 . . . . 0.0 111.128 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 63.38 13.11 6.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.702 -0.624 . . . . 0.0 111.003 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.9 141.38 49.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 58.7 m -107.4 115.08 29.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.321 -0.862 . . . . 0.0 109.942 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 mt -102.44 161.13 13.95 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -0.856 . . . . 0.0 110.378 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -108.76 136.79 47.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.312 -0.868 . . . . 0.0 109.806 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.9 tt -107.31 135.96 47.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.176 -0.952 . . . . 0.0 110.466 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.8 t -125.08 155.97 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.758 . . . . 0.0 110.048 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.06 106.5 18.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.325 -0.86 . . . . 0.0 110.353 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . 0.452 ' NH2' ' CE1' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -85.72 86.11 7.38 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.358 -0.838 . . . . 0.0 110.14 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 58.46 164.81 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.409 -0.807 . . . . 0.0 110.354 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -170.05 145.78 2.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.351 -0.843 . . . . 0.0 110.237 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 123.37 -105.09 0.89 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 CA-C-O 118.017 -1.435 . . . . 0.0 109.517 179.958 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.223 0.535 . . . . 0.0 110.237 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.99 -169.27 2.76 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.34 -0.85 . . . . 0.0 110.245 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mp -112.0 24.48 12.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.444 -0.785 . . . . 0.0 109.654 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.08 66.58 2.51 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -147.83 60.47 1.13 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.304 -1.115 . . . . 0.0 110.226 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.11 166.65 39.62 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.11 -27.81 8.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.44 -1.035 . . . . 0.0 110.221 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.56 -25.96 67.64 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.863 . . . . 0.0 110.285 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.4 -29.13 67.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.268 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.455 ' CD2' ' CG2' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -134.58 106.86 7.2 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.476 -0.765 . . . . 0.0 110.087 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -54.05 143.54 21.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.373 -0.83 . . . . 0.0 109.796 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.461 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 10.5 m-30 -59.72 -14.81 15.89 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.275 -0.89 . . . . 0.0 110.74 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -90.73 -3.89 70.55 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.455 ' CG2' ' CD2' ' A' ' 10' ' ' PHE . 35.6 m -57.12 -26.45 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.048 -1.266 . . . . 0.0 110.398 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -160.21 153.67 18.8 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.342 -0.849 . . . . 0.0 110.173 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.57 -15.11 30.72 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.846 1.446 . . . . 0.0 110.733 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -9.74 58.66 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.294 -0.879 . . . . 0.0 110.588 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -24.41 55.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.12 -0.987 . . . . 0.0 110.292 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.59 120.3 0.59 Allowed Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.351 -0.843 . . . . 0.0 109.853 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.19 -15.34 35.46 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 123.948 1.499 . . . . 0.0 110.111 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.95 -31.87 59.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.43 -0.794 . . . . 0.0 109.37 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.45 -28.86 28.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.598 -0.689 . . . . 0.0 109.293 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.72 -37.98 67.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.55 -36.72 28.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.444 -0.785 . . . . 0.0 109.733 179.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.19 -32.43 72.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.324 -0.86 . . . . 0.0 109.945 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.5 tp -83.0 -21.86 33.8 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.275 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -32.49 29.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.263 -0.898 . . . . 0.0 109.159 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.7 t -80.42 -27.84 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 O-C-N 121.63 -0.669 . . . . 0.0 109.601 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -77.12 -33.91 56.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.8 ttm -74.65 -35.09 62.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 110.028 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.48 -29.9 59.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 110.204 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -50.4 21.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.347 -0.845 . . . . 0.0 110.083 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -60.46 -28.35 68.26 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.389 -0.819 . . . . 0.0 110.196 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -46.83 52.77 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.465 -0.772 . . . . 0.0 110.073 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -62.34 -31.05 71.63 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -81.76 -52.95 6.62 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.35 -0.844 . . . . 0.0 110.115 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.423 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 10.1 mm-40 -60.04 -25.43 65.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.481 -0.762 . . . . 0.0 110.284 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -83.71 -57.26 3.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.494 -0.754 . . . . 0.0 109.577 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -52.54 -35.99 54.62 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.49 -0.756 . . . . 0.0 109.14 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -80.25 -34.28 37.26 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -63.79 -51.11 66.28 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.428 -0.795 . . . . 0.0 109.585 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -70.8 -30.11 66.47 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.617 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -53.57 -39.31 64.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.359 -0.838 . . . . 0.0 109.171 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.36 -25.27 36.47 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.663 -0.648 . . . . 0.0 109.293 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.35 65.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.488 -0.758 . . . . 0.0 109.81 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.61 -41.97 13.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.47 -0.769 . . . . 0.0 110.085 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -26.84 68.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.208 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.3 -33.5 15.3 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.339 -0.851 . . . . 0.0 110.205 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.24 66.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.407 -0.808 . . . . 0.0 110.18 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.73 -17.49 63.46 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.424 -0.797 . . . . 0.0 110.4 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -96.23 -37.43 10.54 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.31 -0.869 . . . . 0.0 110.292 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 -33.01 18.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.391 -0.818 . . . . 0.0 110.249 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.41 -56.74 4.96 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.2 tp -125.8 97.02 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.419 -1.048 . . . . 0.0 110.292 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.26 -25.85 18.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.883 . . . . 0.0 110.266 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.2 p -59.91 105.41 0.38 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.345 -0.847 . . . . 0.0 110.198 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.9 m -158.82 -63.55 0.08 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.456 -0.777 . . . . 0.0 110.098 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -170.01 67.74 0.15 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 9.5 m -120.25 71.49 0.91 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -1.091 . . . . 0.0 110.254 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -81.46 76.23 8.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.346 -0.846 . . . . 0.0 110.141 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.59 -41.93 7.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 110.353 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.2 p -129.07 85.84 2.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.292 -0.88 . . . . 0.0 110.262 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -63.38 -32.04 73.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.399 -0.813 . . . . 0.0 110.268 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -74.96 -30.53 61.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.186 -0.947 . . . . 0.0 109.026 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -48.87 79.88 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.564 -0.855 . . . . 0.0 108.819 179.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.12 -29.89 68.92 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 tt -76.23 -35.33 59.06 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.497 0.665 . . . . 0.0 109.563 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 1.3 mttt -81.22 -58.0 3.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.427 -0.795 . . . . 0.0 110.289 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 mtt -51.0 -37.3 44.25 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.363 -0.836 . . . . 0.0 110.642 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.2 m -70.02 -44.47 69.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 110.261 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.5 tp -83.59 -11.67 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.208 -0.933 . . . . 0.0 110.437 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 3.4 m -77.33 -44.68 28.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.207 -0.933 . . . . 0.0 109.711 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.28 -24.29 37.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.523 -0.736 . . . . 0.0 110.019 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.75 -34.08 22.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -75.63 -40.7 55.87 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.305 -0.872 . . . . 0.0 110.205 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.17 102.38 0.1 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.325 -0.859 . . . . 0.0 110.2 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.95 -83.45 0.16 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -91.29 116.8 29.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.346 -1.091 . . . . 0.0 110.139 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -121.43 41.32 3.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.322 -0.861 . . . . 0.0 110.158 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.92 24.05 32.64 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -172.69 150.08 2.06 Favored Pre-proline 0 N--CA 1.488 1.44 0 O-C-N 121.302 -1.116 . . . . 0.0 108.973 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.415 ' HG3' ' CE2' ' A' ' 95' ' ' TYR . 55.1 Cg_endo -76.29 38.77 0.62 Allowed 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.588 1.309 . . . . 0.0 110.874 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 50.42 82.69 0.05 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.145 -0.972 . . . . 0.0 110.592 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.5 -28.49 18.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.307 -0.871 . . . . 0.0 110.303 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.3 m -62.11 -16.58 53.48 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.369 -0.832 . . . . 0.0 110.566 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 77.7 p -106.16 -24.71 12.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.099 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 14.3 mtt -60.92 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 110.04 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.402 ' OG1' ' HB2' ' A' ' 91' ' ' GLU . 69.4 p -148.35 -170.66 3.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.373 -0.83 . . . . 0.0 110.166 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.596 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.15 -34.64 78.86 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.421 -0.799 . . . . 0.0 109.345 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -85.45 -40.19 16.68 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.6 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.402 ' HB2' ' OG1' ' A' ' 88' ' ' THR . 0.3 OUTLIER -65.11 -42.51 93.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 108.528 179.109 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -70.02 -34.01 72.73 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.596 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.68 -35.69 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.58 -45.52 75.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.585 -0.697 . . . . 0.0 109.551 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.415 ' CE2' ' HG3' ' A' ' 82' ' ' PRO . 9.1 t80 -67.08 -32.68 74.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.84 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.57 -34.64 35.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 110.064 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.8 mmt -83.89 -26.28 29.53 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.907 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -76.95 -31.37 56.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.421 -0.799 . . . . 0.0 110.199 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.6 mmm -85.04 -27.78 26.13 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.391 -0.818 . . . . 0.0 110.209 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -41.06 52.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.276 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.7 mt -73.49 -29.2 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.216 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -68.91 -47.75 65.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.314 -0.866 . . . . 0.0 110.236 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.08 103.46 0.17 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -95.17 61.78 2.46 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.386 -1.067 . . . . 0.0 110.155 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 52.01 81.81 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.348 -0.845 . . . . 0.0 110.518 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -160.32 44.39 0.2 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.37 -0.832 . . . . 0.0 110.133 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -145.91 85.84 0.17 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -149.12 84.2 1.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.364 -1.08 . . . . 0.0 110.258 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -143.9 54.46 1.31 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.294 -0.879 . . . . 0.0 110.211 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.44 53.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.827 . . . . 0.0 110.211 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.1 m -109.02 160.13 16.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.384 -0.822 . . . . 0.0 110.234 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.167 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.266 0.555 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -97.79 146.46 25.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.498 -0.751 . . . . 0.0 109.93 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.8 pt -137.56 159.03 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.34 -0.85 . . . . 0.0 110.269 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -111.93 142.25 44.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.527 -0.733 . . . . 0.0 110.545 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -127.53 117.91 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.399 -0.813 . . . . 0.0 109.602 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.4 mttm -100.2 130.5 46.34 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.411 -0.806 . . . . 0.0 110.599 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 61.2 p -96.01 175.26 6.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.001 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 12.7 mt -61.72 -11.31 11.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.251 -0.906 . . . . 0.0 111.039 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 62.9 p -95.72 13.82 25.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.962 -1.086 . . . . 0.0 110.791 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.64 7.84 70.36 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 21.6 tttm -84.83 130.05 34.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.985 -1.303 . . . . 0.0 109.919 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 41.7 m -113.33 125.58 54.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.359 -0.838 . . . . 0.0 110.245 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.28 136.23 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.414 -0.804 . . . . 0.0 110.417 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.4 m -102.19 120.83 41.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.301 -0.875 . . . . 0.0 109.448 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.9 mt -123.64 168.84 12.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.129 -0.982 . . . . 0.0 110.919 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -106.27 113.71 27.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.472 -0.767 . . . . 0.0 109.492 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 32.3 m -140.68 167.22 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.279 -0.888 . . . . 0.0 110.958 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.69 167.24 9.49 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.535 -0.728 . . . . 0.0 109.06 178.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.94 -26.75 18.3 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.449 1.236 . . . . 0.0 110.39 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.5 -3.15 58.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.183 -0.948 . . . . 0.0 110.523 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.07 141.92 50.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.0 110.47 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.2 p -83.26 158.04 22.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.57 -0.706 . . . . 0.0 110.345 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.425 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 44.5 mm -59.71 -36.41 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.349 -0.844 . . . . 0.0 109.494 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.25 -35.38 75.37 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.23 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -31.79 68.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.461 -0.775 . . . . 0.0 109.19 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -70.11 -41.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.493 -0.754 . . . . 0.0 109.089 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 38.1 mttt -62.93 -42.87 99.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.476 -0.765 . . . . 0.0 109.34 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.24 -33.84 74.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.518 -0.739 . . . . 0.0 109.426 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -68.3 -39.29 82.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.506 -0.746 . . . . 0.0 109.558 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.5 mt -67.12 -38.96 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 119.669 -0.812 . . . . 0.0 109.18 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.65 -50.66 72.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.416 -0.802 . . . . 0.0 109.588 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.11 -25.89 61.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.375 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -84.01 -41.94 16.73 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.169 -0.957 . . . . 0.0 110.722 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -107.99 -54.51 2.49 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.16 -0.962 . . . . 0.0 110.502 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.45 21.45 1.81 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.436 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 15.2 mt -91.45 145.2 30.89 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.131 -1.217 . . . . 0.0 109.797 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.436 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 39.8 Cg_endo -67.28 131.51 25.17 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.586 1.308 . . . . 0.0 110.4 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.73 -24.59 79.16 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.676 1.356 . . . . 0.0 110.741 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.74 -25.11 64.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 109.636 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -101.28 9.78 41.37 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.574 -0.703 . . . . 0.0 110.209 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -94.25 137.04 33.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.206 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.04 123.48 30.6 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.351 -0.843 . . . . 0.0 110.1 179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 25.0 mt -104.52 115.26 30.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.383 -0.823 . . . . 0.0 110.236 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.412 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 1.9 mp -121.12 137.01 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.515 -0.74 . . . . 0.0 109.727 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -140.65 145.65 36.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.43 -0.794 . . . . 0.0 109.82 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.41 29.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.504 -0.747 . . . . 0.0 111.062 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.3 6.43 87.8 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -111.09 131.6 54.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.051 -1.264 . . . . 0.0 110.238 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -78.59 131.68 36.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.257 -0.902 . . . . 0.0 109.615 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.434 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 26.1 mt -83.95 139.01 32.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.904 . . . . 0.0 110.351 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.71 132.43 38.08 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.319 -0.863 . . . . 0.0 110.775 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.425 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 7.8 m-20 -48.42 -28.38 3.22 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.519 -0.738 . . . . 0.0 111.104 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.95 -6.69 88.12 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.59 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -99.38 156.27 17.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.072 -1.252 . . . . 0.0 110.45 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.8 p -102.12 162.24 13.07 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.822 . . . . 0.0 110.249 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 86.8 mt -53.42 -44.72 69.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.315 -0.865 . . . . 0.0 110.667 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.9 t -56.65 -34.5 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.322 -0.861 . . . . 0.0 110.991 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -59.63 -28.06 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.228 -0.92 . . . . 0.0 110.403 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 73.9 m-85 -101.18 27.42 6.15 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.382 -0.824 . . . . 0.0 109.958 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 m120 50.94 31.85 6.72 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.46 -0.775 . . . . 0.0 110.757 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.485 HG21 HD12 ' B' ' 61' ' ' ILE . 88.6 mt -81.7 113.8 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.049 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -105.72 167.93 9.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.367 -0.833 . . . . 0.0 110.122 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 12.2 pttp -46.46 153.09 0.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.496 -0.752 . . . . 0.0 110.918 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.4 OUTLIER 62.48 16.8 8.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.595 -0.691 . . . . 0.0 110.511 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.51 146.18 48.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 110.302 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -107.67 109.17 20.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.391 -0.818 . . . . 0.0 109.957 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -102.56 162.78 12.65 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.293 -0.88 . . . . 0.0 110.075 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -108.75 131.2 55.17 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.215 -0.928 . . . . 0.0 109.906 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 57.6 tp -107.17 128.09 54.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 0.0 110.385 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.2 t -124.93 156.39 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.428 -0.795 . . . . 0.0 110.007 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.0 110.62 22.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -92.7 95.97 9.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.847 . . . . 0.0 110.186 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -86.2 131.62 34.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.421 -0.8 . . . . 0.0 110.253 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -128.3 83.56 2.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.348 -0.845 . . . . 0.0 110.202 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -140.92 -104.71 0.56 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.347 0 CA-C-O 118.008 -1.44 . . . . 0.0 109.525 -179.984 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 121.199 0.523 . . . . 0.0 110.226 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.35 -167.15 1.6 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.421 -0.799 . . . . 0.0 110.167 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 tp -110.99 24.59 12.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.452 -0.78 . . . . 0.0 109.515 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.97 -60.26 1.2 Allowed Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.14 103.94 5.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.45 -1.029 . . . . 0.0 110.204 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -116.48 -144.41 7.99 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -126.16 39.78 3.87 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.362 -1.081 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.59 -28.2 8.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.282 -0.886 . . . . 0.0 110.229 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -27.77 67.92 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.393 -0.817 . . . . 0.0 110.249 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 10' ' ' PHE . 38.2 p90 -163.25 121.61 2.0 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.422 -0.799 . . . . 0.0 110.08 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -157.34 37.7 0.29 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.359 -0.838 . . . . 0.0 110.097 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -167.28 -44.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.824 . . . . 0.0 110.201 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.59 54.92 0.94 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -137.84 -63.72 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.362 -1.081 . . . . 0.0 110.057 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.38 161.7 28.58 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.16 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.03 -20.93 28.3 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.805 1.424 . . . . 0.0 110.618 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 m -62.69 -17.39 60.56 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.71 -25.81 65.11 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.263 -0.898 . . . . 0.0 110.336 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -168.1 116.49 0.63 Allowed Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.324 -0.86 . . . . 0.0 110.08 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -70.94 -14.2 32.19 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 123.977 1.514 . . . . 0.0 110.016 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -74.23 -30.81 62.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.473 -0.767 . . . . 0.0 109.359 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.09 -30.01 22.91 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.41 -36.33 73.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.551 -0.718 . . . . 0.0 109.352 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.12 -32.2 50.31 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.55 -0.719 . . . . 0.0 109.634 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.5 -32.16 70.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.4 -0.812 . . . . 0.0 109.925 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 62.6 tp -82.54 -21.45 35.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.4 -0.813 . . . . 0.0 110.309 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.51 -27.31 34.54 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.259 -0.9 . . . . 0.0 109.314 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.6 t -85.36 -26.31 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.592 -0.693 . . . . 0.0 109.772 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.17 -45.47 26.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.455 -0.778 . . . . 0.0 110.097 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -35.17 71.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.411 -0.806 . . . . 0.0 110.026 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -70.31 -34.63 72.94 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.368 -0.833 . . . . 0.0 110.041 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.9 -45.45 50.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.374 -0.829 . . . . 0.0 110.118 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.96 -47.55 84.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.416 -0.802 . . . . 0.0 110.18 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -40.63 97.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.444 -0.785 . . . . 0.0 110.179 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -53.5 -41.02 65.86 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.397 -0.814 . . . . 0.0 110.203 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -82.51 -47.1 12.57 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.403 -0.811 . . . . 0.0 109.936 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.448 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 6.1 mm100 -63.64 -20.31 65.58 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.363 -0.835 . . . . 0.0 110.262 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -84.13 -65.87 0.96 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.264 -0.897 . . . . 0.0 109.553 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.46 -26.8 21.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.332 -0.855 . . . . 0.0 109.563 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.33 -30.53 23.63 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.535 -0.728 . . . . 0.0 109.875 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.448 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -84.05 -23.61 30.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.272 -0.892 . . . . 0.0 109.98 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.448 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 2.8 mpt_? -82.3 -39.16 23.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.483 -0.761 . . . . 0.0 109.988 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.14 -33.21 63.46 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.81 67.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.355 -0.841 . . . . 0.0 109.991 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.98 -30.58 39.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.424 -0.797 . . . . 0.0 110.083 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.52 -37.87 71.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.069 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.71 -33.98 58.17 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.394 -0.816 . . . . 0.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.9 m -69.45 -35.42 75.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.36 -0.837 . . . . 0.0 110.159 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.95 -26.58 48.9 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.38 20.31 17.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.285 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -143.06 -45.67 0.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 110.065 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.19 16.45 26.1 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.38 -0.825 . . . . 0.0 110.357 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.41 -74.15 0.1 Allowed Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.1 pp -86.46 66.61 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.303 -1.116 . . . . 0.0 110.14 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.58 139.9 48.01 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.83 . . . . 0.0 110.236 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.8 p -141.63 93.97 2.63 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.423 -0.798 . . . . 0.0 110.233 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.6 t -74.23 -158.13 0.06 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.386 -0.821 . . . . 0.0 110.1 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -159.45 98.08 0.17 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.709 -1.357 . . . . 0.0 109.709 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.9 p -81.85 62.71 5.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -1.037 . . . . 0.0 110.061 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 62' ' ' SER . 5.4 pt-20 -142.74 45.68 1.59 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.389 -0.82 . . . . 0.0 110.533 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.631 ' O ' ' N ' ' A' ' 63' ' ' ASP . 3.4 t70 -55.92 97.04 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 60' ' ' GLU . 79.3 p -51.11 78.3 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.666 0.746 . . . . 0.0 110.724 -177.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.2 t0 -61.51 -31.28 71.27 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.736 -0.602 . . . . 0.0 110.165 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -76.11 -29.77 58.0 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.296 -0.877 . . . . 0.0 109.131 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.47 96.8 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.796 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -29.2 70.26 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -40.21 55.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.466 -0.771 . . . . 0.0 109.87 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' SER . 10.8 mmtp -81.79 -55.28 4.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.387 -0.821 . . . . 0.0 110.516 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 tpp -52.37 -42.42 63.95 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.152 -0.968 . . . . 0.0 110.604 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 84.7 m -68.02 -42.86 80.01 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.311 -0.868 . . . . 0.0 110.559 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.3 tp -82.5 -12.99 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.231 -0.918 . . . . 0.0 110.413 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 68' ' ' LYS . 11.9 m -76.08 -39.43 55.37 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.338 -0.851 . . . . 0.0 109.749 179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -84.35 -27.09 27.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.416 -0.802 . . . . 0.0 110.079 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.18 -44.54 14.92 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -69.52 -38.58 77.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 110.202 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -105.62 87.36 2.58 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.877 . . . . 0.0 110.186 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -153.42 -73.4 0.01 OUTLIER Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 -71.92 -32.5 67.41 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.367 -1.078 . . . . 0.0 110.067 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.412 ' O ' ' CG2' ' A' ' 79' ' ' THR . 92.6 m 51.4 27.17 3.53 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.314 -0.866 . . . . 0.0 109.953 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.442 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 87.77 -87.18 1.52 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 108.905 -1.678 . . . . 0.0 108.905 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.442 ' CG ' ' O ' ' A' ' 80' ' ' GLY . 0.2 OUTLIER 176.99 153.69 0.41 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.73 -0.865 . . . . 0.0 108.971 179.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -75.6 48.84 2.25 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 123.59 1.31 . . . . 0.0 110.596 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.59 110.67 21.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.128 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.2 mp -57.88 -26.67 62.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.845 . . . . 0.0 110.217 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -14.51 62.96 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.338 -0.851 . . . . 0.0 110.327 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 t -109.76 -4.31 16.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.283 -0.886 . . . . 0.0 110.412 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 11.3 mtt -96.39 -163.66 1.07 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.202 -0.936 . . . . 0.0 110.129 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.6 p -141.5 -167.81 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.406 -0.808 . . . . 0.0 110.185 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.581 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.3 pt-20 -71.52 -32.36 68.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.457 -0.777 . . . . 0.0 109.207 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -85.24 -38.18 19.21 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.272 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -43.21 89.19 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -68.07 -35.23 77.86 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.81 -37.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.46 -33.35 74.66 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.496 -0.752 . . . . 0.0 109.823 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -75.78 -31.66 59.58 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.36 -32.44 29.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.457 -0.777 . . . . 0.0 110.167 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.54 -29.77 27.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.36 -0.837 . . . . 0.0 109.689 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -75.35 -31.08 60.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.373 -0.829 . . . . 0.0 109.915 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 2.2 tpt -78.51 -37.84 42.13 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.385 -0.822 . . . . 0.0 110.026 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 t -66.67 -28.32 68.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.819 . . . . 0.0 110.083 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -99.94 -31.53 11.43 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.467 -0.771 . . . . 0.0 110.143 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -123.16 59.93 1.07 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.378 -0.826 . . . . 0.0 110.17 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -102.24 -63.92 0.74 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.37 75.44 1.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.376 -1.073 . . . . 0.0 110.22 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.94 -63.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.36 -0.838 . . . . 0.0 110.202 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.31 -40.4 2.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.339 -0.85 . . . . 0.0 110.187 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.43 -35.15 1.57 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -92.33 84.3 5.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.342 -1.093 . . . . 0.0 110.197 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -159.25 -71.05 0.08 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.386 -0.821 . . . . 0.0 110.228 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -104.42 29.95 5.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.147 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.4 p -124.02 155.28 38.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.387 -0.821 . . . . 0.0 110.211 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 117.965 -1.016 . . . . 0.0 110.164 179.964 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.421 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.4 ttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.253 0.549 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 140.68 29.48 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.33 -0.856 . . . . 0.0 109.725 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.41 158.06 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.235 -0.915 . . . . 0.0 110.32 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.81 143.85 42.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.71 -0.619 . . . . 0.0 110.681 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 64.1 t -127.99 124.58 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 109.517 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -99.88 134.11 43.27 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.423 -0.798 . . . . 0.0 110.291 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 40.3 p -95.47 172.89 7.8 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.331 -0.856 . . . . 0.0 110.302 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.446 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.26 -13.54 19.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.486 -0.759 . . . . 0.0 111.034 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.5 p -95.72 -5.77 41.36 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.026 -1.046 . . . . 0.0 110.997 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.99 9.43 57.21 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.62 136.53 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.259 . . . . 0.0 109.779 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 31.0 m -113.07 127.32 56.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.229 -0.919 . . . . 0.0 110.373 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.29 137.27 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 23.3 m -102.09 120.68 40.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.3 mt -123.48 158.59 30.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.095 -1.003 . . . . 0.0 110.918 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -106.29 113.8 27.54 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 109.385 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.0 m -140.29 177.4 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.266 -0.896 . . . . 0.0 110.938 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -113.03 164.61 15.07 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.89 -27.27 17.87 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.523 1.275 . . . . 0.0 110.282 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.63 -1.34 55.9 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.885 . . . . 0.0 110.735 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.99 143.87 50.67 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.073 -1.017 . . . . 0.0 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 81.1 p -83.4 159.15 21.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.491 -0.756 . . . . 0.0 110.606 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.453 HD12 HG23 ' B' ' 23' ' ' ILE . 44.7 mm -59.62 -37.45 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.381 -0.824 . . . . 0.0 109.461 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -60.22 -34.67 73.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.422 -0.799 . . . . 0.0 109.358 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.47 -33.77 71.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.0 109.264 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.1 t -70.04 -40.06 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.454 -0.779 . . . . 0.0 109.26 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -62.9 -42.62 99.85 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.462 -0.774 . . . . 0.0 109.206 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.56 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.481 -0.762 . . . . 0.0 109.368 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -39.8 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.567 -0.708 . . . . 0.0 109.535 179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.8 mt -67.01 -37.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.96 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 50.0 tt0 -60.77 -50.57 72.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.377 -0.827 . . . . 0.0 109.374 178.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -58.07 -27.72 63.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 110.517 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -83.93 -39.04 20.29 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.307 -0.871 . . . . 0.0 110.778 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -108.07 -56.85 2.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 127.23 19.19 1.96 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.079 -1.209 . . . . 0.0 110.079 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.401 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 25.2 mt -91.43 144.03 29.06 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.092 -1.24 . . . . 0.0 109.93 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.6 Cg_endo -68.28 132.3 25.5 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.714 1.376 . . . . 0.0 110.459 179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.67 -25.12 80.28 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.736 1.387 . . . . 0.0 110.816 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -26.15 64.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.418 -0.801 . . . . 0.0 109.84 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.433 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.6 mm100 -101.24 2.5 39.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.446 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -94.21 139.65 30.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.09 129.05 43.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.38 -0.825 . . . . 0.0 110.15 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.4 mt -104.71 118.57 36.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.412 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.0 mp -121.09 135.09 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.436 -0.79 . . . . 0.0 109.992 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -140.73 149.5 42.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.606 -0.684 . . . . 0.0 109.543 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 28.46 0.52 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.423 -0.798 . . . . 0.0 111.088 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.36 2.1 78.14 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -111.04 136.79 49.52 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.093 -1.239 . . . . 0.0 110.215 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -78.4 138.99 38.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.227 -0.921 . . . . 0.0 109.824 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.444 HD23 ' CD2' ' B' ' 59' ' ' TYR . 47.9 mt -83.68 140.8 31.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.374 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.56 128.15 39.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.409 -0.807 . . . . 0.0 110.429 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.437 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 75.4 m-20 -48.35 -29.88 4.39 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.472 -0.767 . . . . 0.0 111.127 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.92 -5.19 89.58 Favored Glycine 0 N--CA 1.493 2.498 0 C-N-CA 120.121 -1.038 . . . . 0.0 110.622 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt-85 -99.34 155.97 17.24 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.983 -1.304 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.508 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.7 p -102.46 165.4 11.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.393 -0.817 . . . . 0.0 110.232 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 64.9 mt -53.78 -47.62 70.57 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.779 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 29.1 t -56.75 -35.95 69.22 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.333 -0.854 . . . . 0.0 111.18 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -59.47 -27.38 66.06 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.107 -0.995 . . . . 0.0 110.236 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.444 ' CD2' HD23 ' B' ' 50' ' ' LEU . 34.2 m-85 -101.37 27.96 5.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.394 -0.816 . . . . 0.0 109.919 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 50.72 26.51 2.56 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.513 -0.742 . . . . 0.0 110.829 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.457 HG22 HD12 ' B' ' 61' ' ' ILE . 96.4 mt -81.53 109.56 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.274 -0.891 . . . . 0.0 109.906 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -105.68 173.38 6.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.379 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.7 151.72 0.56 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 111.088 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 35.0 mt-10 63.0 16.33 9.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.768 -0.582 . . . . 0.0 110.616 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.4 144.61 49.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 12.6 m -107.4 108.46 19.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 109.821 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.9 mt -102.31 160.29 14.66 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.318 -0.864 . . . . 0.0 110.041 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -108.95 132.89 53.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.278 -0.889 . . . . 0.0 110.151 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 61.8 tp -107.21 130.94 54.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.861 . . . . 0.0 109.95 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 16.6 t -124.81 149.58 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.452 -0.78 . . . . 0.0 110.155 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.0 mt -94.46 136.66 34.51 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.471 -0.768 . . . . 0.0 110.155 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 103.45 10.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.154 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.57 111.93 24.81 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.271 -0.893 . . . . 0.0 110.248 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.52 93.77 3.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.343 -0.848 . . . . 0.0 110.184 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -148.16 -134.23 2.42 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 CA-C-O 118.05 -1.417 . . . . 0.0 109.56 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.5 m170 . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.22 0.534 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.2 mtp -68.54 -178.06 1.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.356 -0.84 . . . . 0.0 110.265 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -112.05 24.71 12.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.502 -0.748 . . . . 0.0 109.599 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.49 -129.35 2.53 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.5 mp -116.12 65.35 0.7 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -1.054 . . . . 0.0 110.19 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -99.15 35.25 4.8 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.25 27.51 4.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.356 -1.085 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 t -129.72 24.25 5.39 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 110.337 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -79.69 -24.56 41.66 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.214 -0.929 . . . . 0.0 110.115 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -111.09 72.64 0.79 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.323 -0.861 . . . . 0.0 110.2 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.8 tp10 -106.69 82.09 1.67 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.343 -0.848 . . . . 0.0 110.313 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 51.95 26.93 3.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.396 -0.815 . . . . 0.0 110.605 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -134.74 32.02 2.66 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.1 p -136.27 -39.31 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.305 -1.115 . . . . 0.0 110.353 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -113.53 123.31 33.4 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.308 -0.87 . . . . 0.0 110.014 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.84 -24.03 25.21 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 O-C-N 123.537 1.283 . . . . 0.0 110.681 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.2 t -61.32 -19.15 61.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.265 -0.897 . . . . 0.0 110.269 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.68 -27.39 63.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 110.152 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -159.64 113.69 1.5 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 110.059 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -72.01 -10.27 25.84 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.994 1.523 . . . . 0.0 110.432 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -79.64 -31.94 41.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.876 . . . . 0.0 109.125 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.8 tt -84.57 -29.32 25.95 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.63 -35.11 74.95 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.44 -29.87 53.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.554 -0.716 . . . . 0.0 109.304 179.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.81 -29.67 68.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.463 -0.773 . . . . 0.0 109.777 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.01 -24.73 32.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.404 -0.81 . . . . 0.0 110.14 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -85.0 -30.58 24.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 109.639 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 75.5 t -79.39 -30.97 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.469 -0.769 . . . . 0.0 109.809 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 55.1 m -76.53 -48.66 18.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.988 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.04 -43.03 99.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.354 -0.841 . . . . 0.0 110.02 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.84 -32.55 74.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.44 -0.788 . . . . 0.0 109.875 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.52 -47.21 86.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.43 -0.794 . . . . 0.0 110.024 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.43 -37.55 83.92 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.23 -34.94 77.16 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.434 -0.791 . . . . 0.0 110.096 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.89 -39.05 90.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.406 -0.809 . . . . 0.0 109.902 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -77.44 -44.1 30.2 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.371 -0.83 . . . . 0.0 110.157 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -64.13 -27.78 69.32 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.493 -0.755 . . . . 0.0 110.229 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -83.69 -56.38 3.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.417 -0.802 . . . . 0.0 109.472 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -53.23 -30.93 40.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.81 . . . . 0.0 109.177 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -86.02 -36.79 19.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.773 -0.579 . . . . 0.0 109.457 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -66.67 -53.51 33.05 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.929 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 mtt85 -64.23 -33.85 76.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.468 -0.77 . . . . 0.0 110.087 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -37.46 73.87 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.052 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.18 -27.14 42.62 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.315 -0.865 . . . . 0.0 109.874 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.24 58.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.8 . . . . 0.0 110.122 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.04 -47.9 14.16 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.113 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.08 72.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.865 . . . . 0.0 110.173 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.8 m -83.48 -41.97 17.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.38 -0.825 . . . . 0.0 110.194 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.64 -29.47 65.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.146 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -27.26 68.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.384 -0.823 . . . . 0.0 110.207 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -79.82 89.21 5.23 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.341 -0.85 . . . . 0.0 110.157 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.81 30.1 8.55 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 110.411 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -110.12 -61.18 0.5 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.9 tt -110.97 -18.98 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.286 -1.126 . . . . 0.0 110.363 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.64 -177.62 5.47 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.5 t -114.17 153.71 29.1 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.5 p -118.52 77.69 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.308 -0.87 . . . . 0.0 110.263 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.56 56.78 0.2 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.1 m -95.22 71.33 3.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.352 -1.087 . . . . 0.0 110.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -74.1 79.22 1.74 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.8 -25.99 12.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.396 -0.815 . . . . 0.0 110.238 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 60.2 p -112.37 68.71 0.68 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.168 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.5 -33.19 74.39 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.416 -0.803 . . . . 0.0 110.192 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -76.23 -28.24 57.1 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.205 -0.934 . . . . 0.0 109.221 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.7 99.62 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.584 -0.846 . . . . 0.0 108.882 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.85 -29.66 69.63 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 tt -76.58 -37.53 56.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.578 -0.701 . . . . 0.0 109.871 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 72' ' ' SER . 21.5 mmtm -83.87 -55.24 4.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 110.361 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.9 tpt -52.86 -42.75 65.52 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.7 m -69.96 -41.85 73.95 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.426 ' O ' ' CB ' ' A' ' 75' ' ' GLU . 5.8 tp -83.77 -12.08 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 110.59 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 68' ' ' LYS . 83.5 p -78.78 -45.42 21.06 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.175 -0.953 . . . . 0.0 109.801 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -82.97 -18.78 38.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.499 -0.751 . . . . 0.0 110.267 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -92.76 -34.4 13.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.184 -0.947 . . . . 0.0 110.677 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.426 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.7 tt0 -80.6 -30.4 36.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.23 -0.919 . . . . 0.0 110.448 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.37 105.34 0.11 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.337 -0.852 . . . . 0.0 110.444 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.23 -48.24 0.2 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.77 32.53 4.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.463 -1.022 . . . . 0.0 110.129 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.7 t -79.87 59.75 3.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.398 -0.813 . . . . 0.0 110.086 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.54 4.43 64.26 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.43 ' C ' ' H ' ' A' ' 83' ' ' ASP . 4.6 mp -143.06 130.57 10.95 Favored Pre-proline 0 C--N 1.308 -1.234 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -71.74 42.1 0.48 Allowed 'Trans proline' 0 C--N 1.303 -1.86 0 O-C-N 123.355 1.187 . . . . 0.0 110.728 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.43 ' H ' ' C ' ' A' ' 81' ' ' LEU . 6.9 t70 49.1 91.6 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.798 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.0 -27.74 65.97 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -66.56 -21.93 66.15 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.284 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.5 t -85.24 -24.66 27.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 110.19 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 40.1 mtt -59.96 116.6 4.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.491 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.6 p -73.75 -160.74 0.09 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.496 -0.752 . . . . 0.0 110.433 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.552 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 pt-20 -70.78 -30.04 66.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.514 -0.741 . . . . 0.0 109.149 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.415 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 6.9 mt-10 -83.44 -38.37 21.97 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.491 ' HB2' ' N ' ' A' ' 88' ' ' THR . 69.5 mm-40 -65.37 -43.69 89.98 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -66.95 -35.27 79.6 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.552 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.99 -36.95 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.77 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.96 81.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.79 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.18 -54.52 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.072 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.3 -34.15 74.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.5 ttp -80.91 -25.28 37.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.799 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -41.29 97.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.427 -0.796 . . . . 0.0 109.997 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 41.5 mmm -82.17 -24.73 34.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.378 -0.826 . . . . 0.0 110.231 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -34.62 42.55 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.38 -0.825 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.5 -22.82 62.16 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.35 -0.844 . . . . 0.0 110.284 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.62 -27.7 25.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.293 -0.879 . . . . 0.0 110.194 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 72.27 99.78 0.07 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -160.21 102.13 1.41 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -1.097 . . . . 0.0 110.224 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -87.08 -37.1 17.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.377 -0.827 . . . . 0.0 110.274 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.04 -58.58 0.27 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.385 -0.822 . . . . 0.0 110.267 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.31 -112.6 2.52 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -164.55 113.33 1.12 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.407 -1.055 . . . . 0.0 110.354 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.0 88.82 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.33 -0.856 . . . . 0.0 110.587 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -127.94 42.1 3.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.436 -0.79 . . . . 0.0 110.111 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 28.7 t -169.3 -51.1 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.332 -0.855 . . . . 0.0 110.192 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.265 179.995 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.431 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.3 ttp . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.21 0.528 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.69 140.55 29.41 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.405 -0.81 . . . . 0.0 109.708 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 42.6 pt -137.33 158.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.19 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -111.67 145.88 38.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.557 -0.714 . . . . 0.0 110.427 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.7 t -127.89 122.55 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.452 -0.78 . . . . 0.0 109.95 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.38 128.51 46.43 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.515 -0.741 . . . . 0.0 110.257 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 66.8 p -95.74 177.51 5.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.371 -0.83 . . . . 0.0 110.473 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.12 -16.98 50.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.44 -0.788 . . . . 0.0 110.841 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.6 p -96.04 21.71 8.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.065 -1.022 . . . . 0.0 110.661 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.6 15.96 58.13 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.432 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.9 ttpm? -84.73 131.58 34.55 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.128 -1.219 . . . . 0.0 109.821 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 22.5 m -112.84 125.21 54.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.65 141.52 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.399 -0.813 . . . . 0.0 110.258 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 7.4 m -101.94 120.06 39.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.295 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 mp -123.24 159.64 28.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.211 -0.931 . . . . 0.0 110.978 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.62 114.96 29.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 109.317 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.431 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.7 m -140.15 172.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.241 -0.912 . . . . 0.0 110.883 -179.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -112.86 165.1 13.82 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.54 -28.29 17.79 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.587 1.309 . . . . 0.0 110.384 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -84.66 -2.14 57.09 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.199 -0.938 . . . . 0.0 110.649 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.14 141.67 50.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.22 -0.925 . . . . 0.0 110.538 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.0 p -83.36 159.77 21.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 110.378 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.468 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.4 mm -59.93 -35.46 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.377 -0.827 . . . . 0.0 109.773 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -60.83 -38.04 84.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.828 . . . . 0.0 109.587 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -69.95 -31.51 69.29 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 109.195 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.2 t -70.1 -39.8 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.0 109.086 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.05 -42.16 99.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.565 -0.709 . . . . 0.0 109.144 179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.27 -34.74 75.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.5 -0.75 . . . . 0.0 109.243 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -68.13 -35.48 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.328 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.2 mt -67.71 -42.04 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.447 -0.783 . . . . 0.0 109.279 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 11.4 tt0 -60.11 -49.58 77.09 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.805 . . . . 0.0 109.445 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.35 -25.81 62.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.379 -0.826 . . . . 0.0 110.393 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -84.04 -43.97 14.59 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.262 -0.898 . . . . 0.0 110.873 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -107.99 -50.29 3.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.219 -0.926 . . . . 0.0 110.631 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.55 18.23 3.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 110.074 -1.211 . . . . 0.0 110.074 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.433 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 91.0 mt -91.28 145.32 31.26 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.133 -1.216 . . . . 0.0 109.735 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.433 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 39.2 Cg_endo -67.75 133.93 31.02 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.579 1.304 . . . . 0.0 110.505 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.71 -25.94 81.97 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.781 1.411 . . . . 0.0 110.746 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.7 -21.98 64.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.785 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.424 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.2 mt-30 -101.18 0.59 37.86 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.463 -0.773 . . . . 0.0 110.337 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -94.25 138.51 32.18 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.892 . . . . 0.0 110.472 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -130.06 128.53 42.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.715 179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.418 ' N ' ' CD2' ' B' ' 43' ' ' LEU . 4.5 mm? -104.44 114.94 29.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.367 -0.833 . . . . 0.0 110.37 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.406 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.0 mp -121.23 134.07 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.561 -0.712 . . . . 0.0 109.811 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -140.92 148.6 40.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.421 -0.799 . . . . 0.0 109.95 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.49 28.57 0.51 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 111.134 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.58 2.16 84.38 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.03 130.99 55.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.117 -1.225 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -78.52 136.68 37.62 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.318 -0.864 . . . . 0.0 109.814 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.427 ' HB3' HG13 ' B' ' 23' ' ' ILE . 39.4 mt -83.99 141.09 31.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.302 -0.874 . . . . 0.0 110.303 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -93.79 133.12 37.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.357 -0.84 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.468 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 15.8 m-20 -48.17 -30.62 4.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.514 -0.741 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -5.51 89.21 Favored Glycine 0 N--CA 1.494 2.548 0 C-N-CA 120.159 -1.019 . . . . 0.0 110.732 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.422 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.1 mmt-85 -99.28 155.12 17.67 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.053 -1.263 . . . . 0.0 110.477 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.5 p -102.16 163.97 11.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.46 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 83.5 mt -53.69 -45.44 70.37 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.352 -0.843 . . . . 0.0 110.877 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 18.2 t -56.58 -34.2 66.93 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.408 -0.807 . . . . 0.0 110.956 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -59.7 -27.79 66.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.427 ' CD2' HD21 ' B' ' 50' ' ' LEU . 76.7 m-85 -101.19 26.0 7.58 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -0.844 . . . . 0.0 110.166 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 50.68 30.4 4.9 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.436 -0.79 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.43 HD11 HG22 ' B' ' 61' ' ' ILE . 94.7 mt -81.41 113.64 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.215 -0.928 . . . . 0.0 109.84 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -105.68 170.44 7.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.366 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.1 pttt -46.71 152.46 0.48 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.5 -0.75 . . . . 0.0 111.11 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.4 mm-40 63.31 15.03 8.34 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.688 -0.632 . . . . 0.0 110.696 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.74 144.47 49.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.147 -0.97 . . . . 0.0 110.073 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -107.44 113.18 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.81 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -102.39 162.45 12.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.4 -0.813 . . . . 0.0 110.125 -179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -108.74 132.59 53.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 109.665 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 42.7 tp -106.89 131.25 54.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 110.314 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 45.6 t -124.96 155.88 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.417 -0.802 . . . . 0.0 110.289 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt -94.14 136.32 34.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 110.132 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 32.7 ttt-85 -98.21 82.93 3.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.25 -0.907 . . . . 0.0 110.194 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.53 -170.44 1.86 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.393 -0.817 . . . . 0.0 110.125 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.08 41.76 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.419 -0.801 . . . . 0.0 110.144 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 161.52 121.54 0.58 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 CA-C-O 117.936 -1.48 . . . . 0.0 109.548 -179.997 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.2 p80 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.224 0.535 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mtp -143.49 178.8 7.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.242 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.6 25.0 12.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.436 -0.79 . . . . 0.0 109.527 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.24 51.01 3.38 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 mp -76.82 68.82 3.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.371 -1.076 . . . . 0.0 110.196 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -120.54 36.8 3.25 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -81.53 -31.54 32.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.4 -1.059 . . . . 0.0 110.059 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 p -77.75 -14.27 59.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.779 . . . . 0.0 110.449 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -56.81 -32.52 65.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.224 -0.922 . . . . 0.0 110.318 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -112.25 93.31 4.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.365 -0.835 . . . . 0.0 110.158 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -80.55 61.63 4.34 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.408 -0.808 . . . . 0.0 110.129 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -146.21 70.19 1.22 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.803 . . . . 0.0 110.22 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.9 -63.1 0.59 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.6 p -61.51 -34.92 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.476 -1.014 . . . . 0.0 110.256 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.99 163.25 61.21 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.367 -0.833 . . . . 0.0 110.316 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -71.47 -20.24 27.56 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.854 1.45 . . . . 0.0 110.751 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 t -67.32 -13.61 62.16 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.299 -0.876 . . . . 0.0 110.579 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -86.87 -23.69 25.17 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.185 -0.947 . . . . 0.0 110.504 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -169.47 118.65 0.57 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.191 -0.943 . . . . 0.0 110.156 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.95 -14.61 35.71 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 O-C-N 123.785 1.413 . . . . 0.0 110.184 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -74.15 -31.13 62.59 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.795 . . . . 0.0 109.315 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mp -87.87 -31.15 19.65 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.74 -31.11 66.33 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.291 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.5 tp -80.77 -34.7 34.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.58 -0.7 . . . . 0.0 109.457 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.3 -33.3 75.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.429 -0.794 . . . . 0.0 109.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.09 -22.02 33.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.428 -0.795 . . . . 0.0 110.266 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -82.34 -32.05 29.55 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.254 -0.904 . . . . 0.0 109.12 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.2 t -81.38 -28.33 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.641 -0.662 . . . . 0.0 109.662 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.2 -43.64 56.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.452 -0.78 . . . . 0.0 109.96 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.03 83.68 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.417 -0.802 . . . . 0.0 109.818 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -42.71 99.21 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.444 -0.785 . . . . 0.0 109.951 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -66.05 -44.59 84.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.356 -0.84 . . . . 0.0 109.987 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -66.13 -43.63 86.56 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.475 -0.765 . . . . 0.0 110.034 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.99 -43.68 91.76 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.0 110.12 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.33 -40.26 85.73 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.377 -0.827 . . . . 0.0 110.102 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -37.67 69.07 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.402 -0.811 . . . . 0.0 109.992 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.408 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 1.2 tp60 -75.16 -26.01 58.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.383 -0.823 . . . . 0.0 109.981 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -83.77 -57.5 3.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.421 -0.8 . . . . 0.0 109.677 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -52.37 -31.71 35.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.465 -0.772 . . . . 0.0 109.216 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.1 -34.21 22.25 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.408 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -63.72 -51.65 64.03 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.485 -0.759 . . . . 0.0 109.675 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.5 ptt180 -66.75 -30.99 71.35 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.354 -0.841 . . . . 0.0 109.754 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -54.27 -41.14 68.49 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.37 -0.831 . . . . 0.0 109.182 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.98 -26.05 56.39 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.98 -27.45 64.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.587 -0.696 . . . . 0.0 109.674 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.54 14.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.483 -0.76 . . . . 0.0 110.038 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.17 -30.48 70.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.413 -0.804 . . . . 0.0 110.144 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.03 -42.5 12.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.378 -0.826 . . . . 0.0 110.166 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.45 -32.89 74.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.39 -0.819 . . . . 0.0 110.14 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.88 -27.7 68.98 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.452 -0.78 . . . . 0.0 110.05 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -111.41 27.02 10.07 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -0.847 . . . . 0.0 110.201 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -148.09 -52.62 0.19 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.309 -0.869 . . . . 0.0 110.084 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.66 -49.42 18.58 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.4 mp -110.01 -24.55 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.488 -1.007 . . . . 0.0 110.137 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 58.76 167.05 0.05 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.34 -0.85 . . . . 0.0 110.26 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 10.0 p -105.35 177.04 4.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 110.253 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.3 p -98.13 -176.64 3.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.369 -0.832 . . . . 0.0 110.262 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -121.75 50.62 0.83 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.15 63.57 8.18 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.402 -1.058 . . . . 0.0 110.049 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.06 83.49 7.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.368 -0.833 . . . . 0.0 110.267 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.54 -34.23 76.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.316 -0.865 . . . . 0.0 110.061 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.8 m -111.39 73.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.339 -0.851 . . . . 0.0 110.131 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -73.05 -37.59 66.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.375 -0.828 . . . . 0.0 110.401 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -78.14 -32.9 50.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.169 -0.957 . . . . 0.0 109.471 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.49 -37.06 82.28 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.402 -0.919 . . . . 0.0 108.736 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.9 mt -69.55 -31.44 69.63 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.14 -43.89 55.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.583 -0.698 . . . . 0.0 109.576 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.9 -53.42 8.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.497 -0.752 . . . . 0.0 110.094 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.0 ttt -49.36 -37.34 24.47 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.256 -0.903 . . . . 0.0 110.743 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.5 p -71.09 -39.59 72.05 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.334 -0.854 . . . . 0.0 110.526 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.1 tp -83.93 -16.82 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.256 -0.903 . . . . 0.0 110.289 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.87 -41.19 60.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.946 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -86.63 -19.24 29.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.46 -0.775 . . . . 0.0 110.28 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -92.02 -42.91 9.72 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.28 -0.887 . . . . 0.0 110.338 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.43 -33.3 60.9 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.341 -0.849 . . . . 0.0 110.061 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.401 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 21.6 t80 -96.25 21.35 9.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.45 -0.781 . . . . 0.0 110.327 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.87 -37.04 57.2 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.306 -1.517 . . . . 0.0 109.306 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.38 114.06 28.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.428 -1.042 . . . . 0.0 110.141 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -124.32 41.1 3.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.404 -0.81 . . . . 0.0 110.258 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.64 48.25 1.37 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -172.45 147.7 1.77 Allowed Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.332 -1.099 . . . . 0.0 108.881 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.56 63.78 2.96 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 123.593 1.312 . . . . 0.0 110.46 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 83' ' ' ASP . 36.1 p-10 -54.36 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.342 -0.849 . . . . 0.0 110.465 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.9 mt -94.73 -29.35 14.83 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.285 -0.885 . . . . 0.0 110.181 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.66 -22.08 43.82 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.344 -0.847 . . . . 0.0 110.411 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.4 t -103.49 -19.24 14.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.31 -0.869 . . . . 0.0 110.472 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 26.4 mtp -90.97 129.07 37.02 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.287 -0.883 . . . . 0.0 110.357 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.473 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 81.4 p -72.44 -157.21 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.423 -0.798 . . . . 0.0 110.254 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.562 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.4 mt-10 -75.82 -29.26 58.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.414 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 2.6 mp0 -85.48 -36.53 20.5 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.473 ' HB2' ' N ' ' A' ' 88' ' ' THR . 63.1 mm-40 -66.26 -44.35 83.87 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.562 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -70.64 -33.69 54.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.737 -0.602 . . . . 0.0 109.401 178.92 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.19 91.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.432 -0.793 . . . . 0.0 110.051 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -37.22 21.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 109.967 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.17 -37.88 81.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.271 -0.893 . . . . 0.0 110.185 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.2 ttt -81.51 -22.56 37.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.948 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.82 -44.29 73.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 110.094 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.14 -24.73 43.12 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.379 -0.825 . . . . 0.0 110.316 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.122 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 mt -97.23 14.67 25.17 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.342 -0.849 . . . . 0.0 110.442 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -139.77 41.73 1.99 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.221 -0.924 . . . . 0.0 110.268 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.71 40.08 0.03 OUTLIER Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -170.01 100.11 0.29 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.405 -1.056 . . . . 0.0 110.123 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -46.01 91.27 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.408 -0.807 . . . . 0.0 110.177 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -157.78 -54.99 0.07 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.219 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 131.68 -103.76 0.55 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -79.38 68.09 5.3 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.395 -1.061 . . . . 0.0 110.21 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.69 -38.1 67.65 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.35 -0.844 . . . . 0.0 110.123 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -166.19 70.48 0.13 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.355 -0.841 . . . . 0.0 110.163 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -167.13 115.27 0.81 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.427 -0.796 . . . . 0.0 110.178 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.272 179.944 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.452 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 44.6 ttp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -92.65 139.42 30.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.359 -0.838 . . . . 0.0 109.79 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.6 158.18 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 110.348 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -112.0 144.36 41.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.567 -0.708 . . . . 0.0 110.779 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.79 118.23 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.488 -0.757 . . . . 0.0 109.588 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 34.2 mttt -100.25 129.9 46.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.422 -0.798 . . . . 0.0 110.578 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 40.0 p -96.13 174.98 6.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.377 -0.827 . . . . 0.0 110.136 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.47 -13.6 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.335 -0.853 . . . . 0.0 111.056 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.2 p -95.72 18.13 13.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.099 -1.0 . . . . 0.0 110.698 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.28 11.62 61.94 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -84.96 127.76 34.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.055 -1.262 . . . . 0.0 109.895 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.9 m -112.94 125.15 54.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.264 -0.898 . . . . 0.0 110.272 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 31.6 mt -109.51 138.65 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.464 -0.773 . . . . 0.0 110.492 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.4 m -102.59 121.21 41.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.774 . . . . 0.0 109.452 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.1 mt -123.75 161.41 25.23 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.127 -0.983 . . . . 0.0 111.163 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -106.31 114.59 28.8 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.536 -0.727 . . . . 0.0 109.27 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.9 m -140.2 175.52 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.282 -0.886 . . . . 0.0 110.85 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -113.36 165.88 12.38 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.91 -27.37 17.7 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 O-C-N 123.453 1.238 . . . . 0.0 110.234 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.68 -1.57 56.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.144 -0.972 . . . . 0.0 110.518 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -71.26 143.22 50.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.213 -0.929 . . . . 0.0 110.477 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 75.9 p -83.24 158.24 22.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.597 -0.689 . . . . 0.0 110.396 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.449 HG13 ' HB3' ' B' ' 50' ' ' LEU . 42.8 mm -59.71 -37.58 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 109.413 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -60.0 -34.59 73.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.427 -0.796 . . . . 0.0 109.148 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -70.33 -31.86 69.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.546 -0.721 . . . . 0.0 109.198 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.93 -39.77 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -62.85 -41.73 99.47 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.43 -33.2 73.31 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.551 -0.718 . . . . 0.0 109.229 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 7.2 mttp -68.43 -38.56 81.32 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.991 -0.684 . . . . 0.0 109.504 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 12.5 mt -67.41 -40.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.313 -0.867 . . . . 0.0 109.33 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -60.44 -49.36 77.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.299 -0.876 . . . . 0.0 109.574 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -58.05 -28.2 64.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.504 -0.747 . . . . 0.0 110.46 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.8 mmtt -83.61 -43.11 15.99 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.387 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -108.13 -116.98 0.27 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.36 -0.838 . . . . 0.0 109.842 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.67 22.1 0.21 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 83.0 mt -91.94 141.44 25.39 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.149 -1.206 . . . . 0.0 109.982 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.555 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.5 Cg_endo -71.71 139.16 33.27 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.637 1.336 . . . . 0.0 110.217 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.62 -27.16 84.34 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 O-C-N 123.675 1.355 . . . . 0.0 111.075 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -68.77 -23.6 64.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.287 -0.883 . . . . 0.0 109.904 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.555 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 5.8 mp0 -100.98 2.79 40.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.418 -0.801 . . . . 0.0 110.661 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -94.17 136.51 34.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.178 -0.951 . . . . 0.0 110.5 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -130.21 128.42 41.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.476 -0.765 . . . . 0.0 109.789 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.2 mt -104.54 118.51 36.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.303 -0.873 . . . . 0.0 110.336 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.416 ' N ' ' CD1' ' B' ' 44' ' ' ILE . 1.9 mp -121.23 133.67 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.533 -0.729 . . . . 0.0 109.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.417 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 31.0 t80 -140.77 152.44 45.23 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.367 -0.833 . . . . 0.0 109.995 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.417 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.14 27.43 0.31 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.459 -0.776 . . . . 0.0 111.118 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.73 1.16 83.07 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -110.95 138.05 47.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -1.21 . . . . 0.0 110.226 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -78.7 136.01 37.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.333 -0.854 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.449 ' HB3' HG13 ' B' ' 23' ' ' ILE . 57.5 mt -83.63 139.55 32.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.188 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 129.06 40.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.396 -0.815 . . . . 0.0 110.404 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.439 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 11.8 m-20 -48.4 -27.3 2.53 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.418 -0.801 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.61 86.97 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.118 -1.039 . . . . 0.0 110.564 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.414 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 21.0 mmt180 -99.23 155.8 17.3 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.988 -1.301 . . . . 0.0 110.428 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.3 p -102.2 165.22 11.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.385 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 87.9 mt -53.59 -44.6 69.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.358 -0.839 . . . . 0.0 110.673 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.2 t -56.61 -36.49 69.48 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.451 -0.781 . . . . 0.0 110.865 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.89 -27.71 66.94 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.236 -0.915 . . . . 0.0 110.418 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.416 ' CD2' HD22 ' B' ' 50' ' ' LEU . 71.2 m-85 -101.12 25.28 8.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.352 -0.842 . . . . 0.0 110.209 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 30.1 m120 50.66 30.94 5.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.378 -0.826 . . . . 0.0 110.554 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.436 HD13 HG23 ' B' ' 61' ' ' ILE . 89.1 mt -81.38 112.54 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.856 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -105.65 169.35 8.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.366 -0.834 . . . . 0.0 110.191 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 7.5 pttm -46.51 152.7 0.43 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.582 -0.699 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 61.1 mm-40 63.08 15.42 8.47 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.768 -0.583 . . . . 0.0 110.719 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.92 49.84 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.191 -0.943 . . . . 0.0 110.078 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 17.7 m -107.62 110.74 22.69 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.989 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 mt -102.46 164.29 11.75 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.355 -0.84 . . . . 0.0 110.169 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 67.1 m80 -108.93 132.76 53.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 57.0 tp -107.3 130.34 54.78 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.23 -0.919 . . . . 0.0 110.478 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 46.7 t -124.96 161.07 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.403 -0.811 . . . . 0.0 110.01 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.92 124.72 38.11 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.315 -0.866 . . . . 0.0 110.208 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -87.47 120.05 28.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.851 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 31.1 mt -130.6 130.08 43.55 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.335 -0.853 . . . . 0.0 110.244 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 25.9 ttt-85 -110.11 143.01 40.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.279 -0.888 . . . . 0.0 110.212 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -135.41 -98.25 0.56 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.557 -179.974 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.7 m80 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.247 0.546 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.533 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 57.3 mtp -146.68 -54.79 0.25 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.3 -0.875 . . . . 0.0 110.162 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 2' ' ' MET . 48.4 mt 72.99 41.45 0.5 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.75 -32.07 70.47 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.8 mp -74.76 78.53 2.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -1.041 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.38 -145.95 12.49 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.7 81.08 2.43 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.386 -1.067 . . . . 0.0 110.328 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.67 25.2 3.58 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.279 -0.888 . . . . 0.0 110.575 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 52.22 27.24 4.51 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.287 -0.883 . . . . 0.0 110.493 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.2 t80 57.47 105.17 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.342 -0.849 . . . . 0.0 110.346 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 44.35 1.2 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.324 -0.86 . . . . 0.0 110.306 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -158.23 24.84 0.25 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.306 -0.871 . . . . 0.0 110.238 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -128.51 2.69 6.58 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.965 -1.254 . . . . 0.0 109.965 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.6 m -65.05 -22.94 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.135 -1.215 . . . . 0.0 110.244 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.527 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -159.22 -179.96 1.22 Allowed Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.245 -0.909 . . . . 0.0 110.008 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.527 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 37.3 Cg_endo -61.64 78.87 0.09 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 O-C-N 123.573 1.301 . . . . 0.0 110.662 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 70.21 46.55 0.6 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.99 26.52 0.15 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.142 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.39 108.54 0.48 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.118 -0.989 . . . . 0.0 110.532 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -73.63 -14.09 24.68 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 124.107 1.583 . . . . 0.0 109.668 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -74.2 -33.32 63.38 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.501 -0.75 . . . . 0.0 109.36 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.15 -28.86 34.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.55 -0.719 . . . . 0.0 109.23 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.403 ' CB ' ' HB2' ' A' ' 16' ' ' PRO . . . -73.61 -39.24 64.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 109.661 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.72 -30.3 36.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.433 -0.792 . . . . 0.0 109.863 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.07 -33.35 71.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.9 -24.09 33.29 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.399 -0.813 . . . . 0.0 110.285 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -79.81 -31.22 40.68 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.238 -0.914 . . . . 0.0 109.121 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 66.2 t -78.75 -27.86 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.682 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' CE1' ' B' ' 68' ' ' HIS . 24.6 p -73.15 -45.76 54.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.423 -0.798 . . . . 0.0 109.988 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -32.98 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.352 -0.843 . . . . 0.0 110.009 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.79 -28.2 61.53 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.367 -0.833 . . . . 0.0 110.153 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.31 -41.94 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.317 -0.864 . . . . 0.0 110.007 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.4 -29.18 67.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.347 -0.846 . . . . 0.0 110.024 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -39.47 65.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.875 . . . . 0.0 110.199 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.25 -36.92 85.61 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.387 -0.82 . . . . 0.0 110.184 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -74.78 -47.17 32.36 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.391 -0.818 . . . . 0.0 110.154 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.439 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 1.0 OUTLIER -68.63 -26.89 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.436 -0.79 . . . . 0.0 110.036 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -78.95 -53.28 7.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.483 -0.761 . . . . 0.0 109.659 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -54.06 -28.13 36.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.121 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -92.72 -33.79 14.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.646 -0.659 . . . . 0.0 109.546 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.439 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -68.35 -38.56 81.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.235 -0.916 . . . . 0.0 109.858 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -80.78 -35.06 33.65 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.462 -0.774 . . . . 0.0 110.007 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mmm180 -56.61 -41.32 76.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.299 -0.876 . . . . 0.0 109.97 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.13 -28.35 35.14 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.352 -0.842 . . . . 0.0 109.996 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.77 -30.01 59.0 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.497 -0.752 . . . . 0.0 110.106 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.03 -38.44 27.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.86 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.16 -33.74 76.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.49 -0.756 . . . . 0.0 110.241 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.77 -30.61 26.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.384 -0.823 . . . . 0.0 110.23 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.68 65.24 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.357 -0.84 . . . . 0.0 110.243 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.6 56.48 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.34 -0.85 . . . . 0.0 110.537 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -88.93 -67.26 0.85 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.144 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.83 -22.52 18.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.427 -0.795 . . . . 0.0 110.278 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.76 -102.08 0.04 OUTLIER Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 tp -115.05 80.8 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.402 -1.058 . . . . 0.0 110.282 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.6 176.85 1.76 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.214 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 m -62.44 142.66 57.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.454 -0.779 . . . . 0.0 110.137 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -21.32 16.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.43 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -136.97 94.19 0.22 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.2 p -91.62 47.42 1.36 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.33 -1.1 . . . . 0.0 110.233 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -140.43 76.95 1.58 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.339 -0.85 . . . . 0.0 110.106 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.02 -28.93 69.83 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.384 -0.823 . . . . 0.0 110.272 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.8 m -123.92 80.83 1.85 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.339 -0.851 . . . . 0.0 110.282 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.13 -36.44 79.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.393 -0.817 . . . . 0.0 110.242 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.0 -29.04 60.76 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.193 -0.942 . . . . 0.0 109.145 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.55 96.43 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.597 -0.841 . . . . 0.0 108.855 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tp -64.78 -28.52 69.63 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 tt -74.69 -47.71 30.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.52 -0.737 . . . . 0.0 109.875 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.01 -52.61 8.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.484 -0.76 . . . . 0.0 110.617 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.4 ttp -51.89 -38.86 57.76 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.226 -0.921 . . . . 0.0 110.65 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.5 m -70.31 -42.28 72.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.325 -0.86 . . . . 0.0 110.357 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.7 tp -81.53 -15.62 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.191 -0.943 . . . . 0.0 110.081 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -74.16 -39.89 62.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.394 -0.816 . . . . 0.0 109.672 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -80.88 -29.3 35.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.476 -0.765 . . . . 0.0 109.862 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -81.64 -49.46 10.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.41 -0.806 . . . . 0.0 110.105 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.16 -40.5 96.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.301 -0.874 . . . . 0.0 110.012 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -78.57 -23.83 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.44 86.93 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -79.27 102.26 8.49 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.451 -1.029 . . . . 0.0 110.109 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.02 81.02 1.39 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.292 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -129.03 38.55 2.0 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -170.86 146.17 2.13 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.35 -1.088 . . . . 0.0 108.928 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.44 62.87 2.83 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.506 1.266 . . . . 0.0 110.303 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -57.42 96.06 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.421 -0.799 . . . . 0.0 110.453 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 tp -85.09 -30.13 24.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.392 -0.817 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 61.5 m -71.72 -9.58 58.5 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.426 -0.796 . . . . 0.0 110.538 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.9 t -119.99 23.9 10.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.215 -0.928 . . . . 0.0 110.053 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.9 mtt -116.84 -162.37 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.425 -0.797 . . . . 0.0 109.898 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.1 p -141.51 -174.33 4.01 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.33 -0.856 . . . . 0.0 110.283 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.599 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.9 pt-20 -65.06 -32.77 74.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.548 -0.72 . . . . 0.0 109.356 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -85.32 -41.2 15.72 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 120.074 -0.65 . . . . 0.0 109.362 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -63.95 -39.89 95.18 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -71.8 -35.13 69.89 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.599 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -63.19 -41.1 91.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.846 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.26 -31.11 71.64 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.42 ' CE2' ' HE3' ' A' ' 99' ' ' MET . 2.7 t80 -82.97 -36.06 25.42 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.737 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.98 -35.55 66.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.445 -0.784 . . . . 0.0 110.037 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.1 ppp? -79.22 -25.65 42.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.457 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -70.56 -33.78 71.5 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.451 -0.781 . . . . 0.0 109.849 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.42 ' HE3' ' CE2' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -80.19 -30.99 38.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.478 -0.764 . . . . 0.0 110.084 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.9 -28.54 60.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.36 -0.837 . . . . 0.0 110.224 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.43 -28.61 31.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.293 -0.88 . . . . 0.0 110.231 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.37 -49.69 7.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.305 -0.872 . . . . 0.0 110.151 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 81.07 100.74 0.34 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -152.56 71.57 0.94 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.353 -1.086 . . . . 0.0 110.202 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -116.38 -49.27 2.67 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 110.222 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.66 -49.95 19.47 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.395 -0.816 . . . . 0.0 110.138 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.0 70.41 1.17 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -117.44 96.92 5.62 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.345 -1.091 . . . . 0.0 110.189 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -143.03 -66.49 0.38 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.448 -0.782 . . . . 0.0 110.18 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -69.68 -53.24 19.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.45 -0.781 . . . . 0.0 110.16 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.2 t -75.37 144.64 42.19 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.262 -0.899 . . . . 0.0 110.136 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.191 179.975 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.334 0.588 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -97.47 146.38 25.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -0.783 . . . . 0.0 110.035 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.1 pt -137.53 157.4 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 110.025 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.404 ' CE1' ' OG1' ' B' ' 14' ' ' THR . 81.1 m-85 -111.68 143.59 42.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.686 -0.634 . . . . 0.0 110.638 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -127.78 118.56 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.42 -0.8 . . . . 0.0 109.405 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -100.1 138.05 37.71 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.365 -0.835 . . . . 0.0 110.574 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 42.5 p -96.14 170.13 9.48 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.455 -0.778 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 17.5 mt -61.7 -10.58 8.96 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.407 -0.808 . . . . 0.0 111.181 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.3 p -95.29 -24.38 16.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.961 -1.087 . . . . 0.0 110.507 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.6 7.31 10.9 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -84.64 128.56 34.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.057 -1.26 . . . . 0.0 109.943 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.4 m -113.16 125.29 54.18 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 110.198 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.19 135.67 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.41 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.404 ' OG1' ' CE1' ' B' ' 4' ' ' PHE . 7.1 m -102.43 119.26 38.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 109.532 179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.3 mt -123.58 166.97 14.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.107 -0.996 . . . . 0.0 110.859 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -106.5 114.63 28.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 109.382 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 33.0 m -140.39 169.53 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.991 -179.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -112.46 166.18 11.52 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.512 -0.742 . . . . 0.0 109.101 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.48 -26.44 20.16 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.499 1.263 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.63 -2.4 57.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.133 -0.979 . . . . 0.0 110.474 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -71.28 141.35 50.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.157 -0.964 . . . . 0.0 110.396 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 44.0 p -83.43 157.51 22.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.542 -0.724 . . . . 0.0 110.385 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.423 HG21 HD12 ' B' ' 23' ' ' ILE . 39.9 mm -59.55 -31.18 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.259 -0.901 . . . . 0.0 109.529 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.93 -36.91 85.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.486 -0.759 . . . . 0.0 109.377 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -32.89 70.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.486 -0.759 . . . . 0.0 109.206 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.02 -39.86 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.434 -0.791 . . . . 0.0 109.126 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -63.02 -42.39 99.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.49 -0.756 . . . . 0.0 109.147 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.01 74.72 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.538 -0.726 . . . . 0.0 109.392 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -68.31 -39.74 81.93 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.459 -0.776 . . . . 0.0 109.616 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.3 mt -67.2 -38.8 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.373 -0.829 . . . . 0.0 109.248 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -52.41 65.24 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.473 -0.767 . . . . 0.0 109.768 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -58.09 -26.69 62.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.412 -0.805 . . . . 0.0 110.575 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.1 mmtm -83.97 -39.01 20.25 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.25 -0.906 . . . . 0.0 110.986 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -107.97 -54.89 2.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.208 -0.933 . . . . 0.0 110.501 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.75 14.28 2.34 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 23.0 mt -91.28 143.35 28.17 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.007 -1.29 . . . . 0.0 109.756 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.523 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.3 Cg_endo -69.88 137.06 34.23 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 123.665 1.35 . . . . 0.0 110.501 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.77 -27.04 84.16 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 O-C-N 123.728 1.383 . . . . 0.0 111.197 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.65 -22.62 64.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.262 -0.899 . . . . 0.0 109.88 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.523 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.5 mp0 -101.12 -1.87 32.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.417 -0.802 . . . . 0.0 110.518 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.01 140.95 29.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.181 -0.949 . . . . 0.0 110.492 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.13 127.62 40.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 109.853 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.2 mt -104.58 118.17 35.92 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.93 . . . . 0.0 110.223 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 1.9 mp -121.2 137.95 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.493 -0.755 . . . . 0.0 109.821 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.412 ' CD2' HD23 ' B' ' 67' ' ' LEU . 47.8 t80 -140.79 147.83 39.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.438 -0.789 . . . . 0.0 109.795 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 29.05 0.54 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.407 -0.808 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.13 6.01 87.41 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 110.621 -0.991 . . . . 0.0 110.621 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mtmm -110.96 134.44 52.58 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.054 -1.262 . . . . 0.0 110.293 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.38 131.07 36.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.866 . . . . 0.0 109.542 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.432 HD21 ' CE2' ' B' ' 59' ' ' TYR . 38.7 mt -83.65 135.55 34.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -93.5 132.88 37.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.396 -0.815 . . . . 0.0 110.578 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.404 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.2 m-20 -48.38 -26.29 2.0 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.588 -0.695 . . . . 0.0 111.165 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.8 -7.81 86.8 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.5 mmt-85 -99.54 154.23 18.41 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.266 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 23.3 p -102.4 164.18 11.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.374 -0.828 . . . . 0.0 110.174 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 92.8 mt -53.53 -43.35 68.29 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.266 -0.896 . . . . 0.0 110.671 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 13.2 t -56.81 -36.24 69.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.402 -0.811 . . . . 0.0 110.971 -179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.62 -27.75 66.59 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.231 -0.918 . . . . 0.0 110.398 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.432 ' CE2' HD21 ' B' ' 50' ' ' LEU . 80.3 m-85 -100.92 25.83 7.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.228 -0.92 . . . . 0.0 110.068 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 50.65 30.31 4.8 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.444 HG23 HD12 ' B' ' 61' ' ' ILE . 90.9 mt -81.35 113.07 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.402 -0.811 . . . . 0.0 109.934 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -105.58 171.82 7.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.452 -0.78 . . . . 0.0 110.179 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 pttp -46.51 152.39 0.46 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.487 -0.758 . . . . 0.0 111.0 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 5.1 mt-10 62.74 16.35 8.9 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.693 -0.63 . . . . 0.0 110.639 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.05 49.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.041 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.3 m -107.62 111.1 23.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.344 -0.848 . . . . 0.0 109.977 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.412 HD23 ' CD2' ' B' ' 45' ' ' PHE . 1.3 mt -102.55 164.92 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.325 -0.86 . . . . 0.0 110.13 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.411 ' CE1' ' HA ' ' A' ' 29' ' ' SER . 71.3 m80 -108.79 132.37 54.05 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.301 -0.874 . . . . 0.0 110.186 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 59.6 tp -107.3 131.4 54.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.346 -0.846 . . . . 0.0 110.255 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 39.5 t -124.88 152.53 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 89.0 mt -94.33 133.6 37.71 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.458 -0.776 . . . . 0.0 110.188 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -86.68 135.84 33.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.342 -0.849 . . . . 0.0 110.236 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.2 mt -97.51 -175.55 3.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.807 . . . . 0.0 110.127 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -128.48 77.05 1.75 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.238 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 145.32 151.36 5.4 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 CA-C-O 118.009 -1.439 . . . . 0.0 109.522 -179.994 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 24.7 t60 . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.19 0.519 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.6 mmm -128.6 175.42 8.58 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 0.0 110.305 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.6 mp -112.25 24.72 12.27 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.509 -0.744 . . . . 0.0 109.588 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.09 -30.76 41.09 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.7 mp -106.49 40.09 1.69 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.365 -1.08 . . . . 0.0 110.169 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.15 152.06 23.68 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.98 32.76 13.31 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.408 -1.054 . . . . 0.0 110.432 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.3 p 50.42 32.0 6.01 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.439 -0.788 . . . . 0.0 110.624 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.9 t0 52.2 30.51 7.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.453 -0.779 . . . . 0.0 110.533 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 57.95 104.94 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.29 -0.881 . . . . 0.0 110.348 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -98.16 82.24 2.91 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.29 -0.882 . . . . 0.0 110.244 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -154.84 43.27 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.31 -0.869 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.05 -52.73 0.79 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.34 -27.85 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.404 -1.057 . . . . 0.0 110.218 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -104.39 153.56 38.98 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.36 -0.837 . . . . 0.0 110.237 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.72 -16.16 29.98 Favored 'Trans proline' 0 C--N 1.309 -1.529 0 O-C-N 123.853 1.449 . . . . 0.0 110.753 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -10.35 59.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.281 -0.887 . . . . 0.0 110.541 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.36 8.71 38.12 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.129 -0.982 . . . . 0.0 110.533 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.54 119.2 0.57 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.187 -0.946 . . . . 0.0 109.743 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.39 -15.75 38.66 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 O-C-N 123.97 1.511 . . . . 0.0 110.154 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -75.21 -29.79 60.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.406 -0.809 . . . . 0.0 109.426 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 tp -89.46 -31.16 17.82 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.553 -0.717 . . . . 0.0 109.259 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.65 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.547 -0.721 . . . . 0.0 109.223 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.5 tp -76.58 -38.62 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.538 -0.726 . . . . 0.0 109.482 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.04 -29.75 71.07 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.394 -0.816 . . . . 0.0 109.53 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.95 -21.28 34.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.591 -0.693 . . . . 0.0 110.211 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -84.25 -32.23 24.55 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.334 -0.854 . . . . 0.0 109.709 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.0 t -78.45 -38.2 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.451 -0.78 . . . . 0.0 109.907 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.3 m -72.86 -41.98 64.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.849 . . . . 0.0 109.903 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 20.9 ttt -62.3 -35.92 80.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.372 -0.83 . . . . 0.0 109.957 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -69.78 -36.71 75.96 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 109.945 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.19 -44.43 83.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.382 -0.824 . . . . 0.0 110.046 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -34.83 77.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.357 -0.839 . . . . 0.0 110.091 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -41.94 81.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.36 -0.838 . . . . 0.0 109.923 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.13 -33.44 70.87 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.472 -0.768 . . . . 0.0 109.9 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -47.05 13.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.386 -0.821 . . . . 0.0 109.97 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.425 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 6.7 tm0? -58.88 -32.67 69.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.845 . . . . 0.0 110.039 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -83.93 -57.78 3.06 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.475 -0.766 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.6 -34.72 52.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.471 -0.768 . . . . 0.0 109.327 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -81.78 -32.84 31.21 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.551 -0.718 . . . . 0.0 109.076 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.425 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -65.63 -45.17 84.1 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.694 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -76.79 -31.99 57.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.375 -0.828 . . . . 0.0 109.882 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -53.97 -41.27 67.67 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.328 -0.858 . . . . 0.0 109.333 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.72 40.25 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.14 -28.35 69.58 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.609 -0.682 . . . . 0.0 109.687 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.32 -46.87 9.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.498 -0.751 . . . . 0.0 110.025 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.79 -30.12 71.11 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 109.982 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.1 m -79.33 -40.99 28.96 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.401 -0.812 . . . . 0.0 110.285 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.12 66.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.393 -0.817 . . . . 0.0 110.291 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.38 30.98 2.35 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.321 -0.862 . . . . 0.0 110.251 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -147.1 -48.38 0.18 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.387 -0.82 . . . . 0.0 110.207 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -140.25 30.94 1.95 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.329 -0.857 . . . . 0.0 110.244 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -119.5 -66.86 0.29 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.8 pt -116.36 62.64 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.362 -1.081 . . . . 0.0 110.135 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.41 133.8 35.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.368 -0.832 . . . . 0.0 110.369 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 25.4 p -101.24 83.71 2.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.127 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 m -135.73 -47.44 0.68 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.33 -0.856 . . . . 0.0 110.211 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.75 87.53 0.1 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.1 t -117.18 55.09 0.85 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.45 -1.03 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.76 93.87 4.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.296 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.12 -60.63 1.73 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.142 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 m -119.49 74.75 1.02 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.367 -0.833 . . . . 0.0 110.062 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.94 -35.91 74.89 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.416 -0.803 . . . . 0.0 110.319 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.84 -32.08 57.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.252 -0.905 . . . . 0.0 109.29 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.28 82.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.49 -0.884 . . . . 0.0 108.784 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -70.51 -29.43 65.93 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.0 tt -76.88 -40.89 45.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.55 -0.719 . . . . 0.0 109.874 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.0 tptt -82.97 -50.17 8.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.403 -0.811 . . . . 0.0 110.529 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.5 tpt -57.46 -40.59 78.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.6 m -69.72 -40.57 76.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.271 -0.893 . . . . 0.0 110.414 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.3 tp -83.66 -16.5 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 O-C-N 121.215 -0.928 . . . . 0.0 110.288 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -73.91 -42.03 61.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.252 -0.905 . . . . 0.0 109.782 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -81.51 -26.12 35.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.44 -0.787 . . . . 0.0 110.026 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -83.83 -48.14 10.37 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.444 -0.785 . . . . 0.0 110.237 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -65.26 -30.47 71.35 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.056 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -88.21 115.48 25.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.365 -0.834 . . . . 0.0 110.221 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.11 -59.91 0.06 OUTLIER Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.26 106.08 4.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.414 -1.05 . . . . 0.0 110.199 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.5 m -113.83 32.55 5.76 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.331 -0.856 . . . . 0.0 110.227 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.76 10.37 74.98 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 110.004 -1.239 . . . . 0.0 110.004 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.25 151.42 1.66 Allowed Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.136 -1.214 . . . . 0.0 108.94 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -76.77 37.95 0.6 Allowed 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 123.524 1.276 . . . . 0.0 110.762 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 50.72 47.26 24.75 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.129 -0.982 . . . . 0.0 110.632 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 tp -90.6 -27.15 19.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.198 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 80.4 p -58.68 -22.74 57.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.332 -0.855 . . . . 0.0 110.431 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -91.83 -26.96 18.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.295 -0.878 . . . . 0.0 110.189 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 32.1 mtt -69.36 121.59 17.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p -78.23 -164.59 0.56 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.423 -0.798 . . . . 0.0 110.435 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.567 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 pt-20 -66.1 -32.42 73.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.617 -0.677 . . . . 0.0 109.317 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.401 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.2 mp0 -85.3 -40.36 16.65 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.26 -41.43 99.04 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -71.14 -35.4 71.68 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.567 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.9 -38.7 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -34.42 78.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.455 -0.778 . . . . 0.0 109.736 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -80.0 -44.23 20.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.417 -0.802 . . . . 0.0 110.16 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.32 -31.7 67.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.294 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 56.2 tpp -82.54 -20.81 35.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.365 -0.835 . . . . 0.0 109.981 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -38.82 55.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 110.096 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 79.9 mtp -84.79 -25.14 28.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.393 -0.817 . . . . 0.0 110.292 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -79.5 -33.35 42.24 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.285 -0.884 . . . . 0.0 110.325 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.38 -35.49 58.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.3 -0.875 . . . . 0.0 110.276 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 41.5 mm-40 -107.65 36.18 2.83 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.231 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -114.34 -133.12 5.53 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.18 67.95 1.35 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.304 -1.115 . . . . 0.0 110.22 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.23 32.38 4.48 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.34 -0.85 . . . . 0.0 110.103 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -166.11 83.0 0.3 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -0.847 . . . . 0.0 110.258 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.46 -30.47 2.69 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -145.82 69.74 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.424 -1.044 . . . . 0.0 110.273 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.74 -62.41 0.11 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.289 -0.882 . . . . 0.0 110.255 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -85.92 -28.75 24.12 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.31 -0.869 . . . . 0.0 110.25 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 28.5 t -73.09 -39.38 65.86 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.395 -0.816 . . . . 0.0 110.208 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.248 179.974 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.153 0.501 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -87.65 140.42 29.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.371 -0.831 . . . . 0.0 109.882 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.1 pt -137.64 159.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -0.859 . . . . 0.0 110.614 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.406 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 81.1 m-85 -111.96 142.19 44.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.647 -0.658 . . . . 0.0 110.551 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 94.3 t -128.17 125.08 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.431 -0.793 . . . . 0.0 109.723 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.23 130.12 46.32 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.439 -0.788 . . . . 0.0 110.514 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 19.7 p -95.79 177.66 5.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.424 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -16.19 42.18 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.431 -0.793 . . . . 0.0 111.007 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.9 19.59 11.24 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.038 -1.039 . . . . 0.0 110.693 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.9 12.8 58.17 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.92 133.37 34.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.073 -1.251 . . . . 0.0 109.825 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.3 m -113.21 125.59 54.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 16.2 mt -109.13 136.67 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.384 -0.823 . . . . 0.0 110.466 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.406 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 11.4 m -102.19 118.52 37.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.412 -0.805 . . . . 0.0 109.222 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.0 mt -123.27 165.29 17.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.137 -0.977 . . . . 0.0 110.883 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -106.35 117.12 33.21 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.381 -0.825 . . . . 0.0 109.743 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.424 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.4 m -140.42 176.21 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.331 -0.856 . . . . 0.0 110.712 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -113.06 163.86 16.98 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.571 -0.706 . . . . 0.0 109.137 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.06 -27.17 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.507 1.267 . . . . 0.0 110.332 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.3 p -84.71 -3.11 58.4 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.099 -1.0 . . . . 0.0 110.704 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -71.38 140.08 50.02 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.097 -1.002 . . . . 0.0 110.687 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.43 161.37 21.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.551 -0.718 . . . . 0.0 110.371 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.429 ' N ' HD13 ' B' ' 23' ' ' ILE . 1.7 mp -59.14 -34.03 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.733 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -60.61 -37.76 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -0.941 . . . . 0.0 109.339 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -31.24 68.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.445 -0.784 . . . . 0.0 109.425 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 88.3 t -70.28 -42.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.411 -0.806 . . . . 0.0 109.38 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.8 mttt -63.0 -41.77 99.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.474 -0.766 . . . . 0.0 109.251 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -35.22 76.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.446 -0.784 . . . . 0.0 109.282 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 8.4 mttm -68.3 -38.18 81.37 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 109.661 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.6 mt -67.3 -40.31 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.103 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.52 -49.63 76.79 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.449 -0.782 . . . . 0.0 109.462 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.12 -26.53 62.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.326 -0.859 . . . . 0.0 110.314 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -83.91 -41.24 17.62 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.406 -0.809 . . . . 0.0 110.739 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.06 -56.1 2.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.264 -0.898 . . . . 0.0 110.417 -179.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.57 19.57 1.65 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.402 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 22.6 mt -91.31 143.89 28.95 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.061 -1.258 . . . . 0.0 109.644 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.492 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.3 Cg_endo -68.2 133.64 29.18 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.614 1.323 . . . . 0.0 110.482 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.77 -23.81 77.35 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.79 1.416 . . . . 0.0 110.991 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.82 -23.77 64.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.252 -0.905 . . . . 0.0 109.762 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.492 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.38 0.63 40.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.428 -0.795 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -94.22 137.61 33.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.198 -0.939 . . . . 0.0 110.407 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -130.12 132.01 45.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 39.2 mt -104.79 118.03 35.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.398 -0.814 . . . . 0.0 110.673 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.404 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.0 mp -121.33 133.41 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.5 -0.75 . . . . 0.0 109.797 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 11.4 t80 -141.25 155.54 46.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.397 -0.814 . . . . 0.0 109.977 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.426 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 44.7 24.75 0.11 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.424 -0.797 . . . . 0.0 111.558 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.8 -8.86 67.56 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.119 -1.039 . . . . 0.0 110.851 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' B' ' 45' ' ' PHE . 9.2 ptmt -110.69 142.14 43.0 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.809 -1.406 . . . . 0.0 110.484 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.4 137.26 37.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.346 -0.846 . . . . 0.0 109.908 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.44 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 24.9 mt -83.79 148.84 26.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.333 -0.854 . . . . 0.0 110.346 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -93.48 130.25 39.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.298 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -48.56 -28.13 3.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.494 -0.754 . . . . 0.0 111.079 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 -3.05 90.66 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 12.2 mmt180 -99.49 155.99 17.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.126 -1.22 . . . . 0.0 110.346 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.55 163.19 12.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.388 -0.82 . . . . 0.0 110.182 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 85.9 mt -53.24 -45.74 68.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.281 -0.887 . . . . 0.0 110.574 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.5 t -56.93 -35.89 69.58 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.415 -0.803 . . . . 0.0 110.838 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -59.6 -29.43 67.97 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.307 -0.871 . . . . 0.0 110.44 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.44 ' CE2' ' HB3' ' B' ' 50' ' ' LEU . 41.8 m-85 -101.07 28.48 5.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.352 -0.843 . . . . 0.0 109.977 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 26.2 m-20 50.7 28.23 3.45 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.512 -0.743 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.481 HD13 HG21 ' B' ' 61' ' ' ILE . 88.0 mt -81.47 110.19 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.394 -0.816 . . . . 0.0 109.876 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -105.62 172.48 6.77 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.282 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.3 pttt -46.62 151.97 0.52 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.477 -0.765 . . . . 0.0 110.995 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 4.0 mm-40 62.76 15.94 8.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.783 -0.573 . . . . 0.0 110.623 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.61 145.23 49.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.929 . . . . 0.0 110.162 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 39.8 m -107.76 109.78 21.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.842 . . . . 0.0 110.082 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -102.29 161.58 13.58 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.345 -0.847 . . . . 0.0 110.043 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -108.64 132.01 54.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 109.909 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 32.9 tp -107.05 136.09 47.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.318 -0.864 . . . . 0.0 110.165 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.77 149.68 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.862 . . . . 0.0 109.953 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 60.1 mt -94.35 119.05 32.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.496 -0.752 . . . . 0.0 110.22 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.84 85.46 2.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.315 -0.866 . . . . 0.0 110.149 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 mt -60.65 111.25 1.54 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.432 -0.793 . . . . 0.0 110.246 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -104.33 86.0 2.46 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.16 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -168.87 -102.48 0.16 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 118.011 -1.439 . . . . 0.0 109.537 179.994 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.226 0.536 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 6.7 mmm -143.48 -176.07 4.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.357 -0.839 . . . . 0.0 110.102 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 pp -110.3 18.88 19.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.46 -0.775 . . . . 0.0 109.847 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.42 66.13 3.73 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.57 14.91 19.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 110.492 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.11 32.6 0.16 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.25 -47.33 9.53 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.288 -1.125 . . . . 0.0 110.183 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 93.3 p -101.29 31.37 3.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -0.841 . . . . 0.0 110.22 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.21 -23.56 24.72 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.333 -0.854 . . . . 0.0 110.388 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' O ' ' CD2' ' A' ' 10' ' ' PHE . 40.2 p90 -162.56 122.23 2.32 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.28 -0.887 . . . . 0.0 110.3 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -166.53 34.45 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.849 . . . . 0.0 110.271 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -170.42 -39.95 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.312 -0.868 . . . . 0.0 110.459 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -102.65 8.37 54.56 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.41 HG12 ' HB2' ' A' ' 10' ' ' PHE . 34.4 m -60.56 -35.4 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.087 -1.243 . . . . 0.0 110.263 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -97.54 156.21 36.39 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.502 -0.749 . . . . 0.0 110.218 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.47 -16.58 30.75 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 O-C-N 123.741 1.39 . . . . 0.0 110.808 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.81 -10.74 60.16 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.232 -0.917 . . . . 0.0 110.541 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.82 1.42 50.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.159 -0.963 . . . . 0.0 110.739 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -168.05 117.23 0.65 Allowed Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.128 -0.983 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -70.09 -14.58 35.21 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 123.918 1.483 . . . . 0.0 110.03 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -74.46 -34.09 63.06 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 109.333 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.4 mt -82.48 -29.44 30.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.628 -0.67 . . . . 0.0 109.326 179.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.31 -34.34 65.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.453 -0.779 . . . . 0.0 109.551 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.3 mt -81.89 -32.86 30.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.408 -0.808 . . . . 0.0 109.566 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.65 74.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.475 -0.766 . . . . 0.0 109.798 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.74 -24.99 33.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.382 -0.824 . . . . 0.0 110.229 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.79 -26.95 29.18 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.663 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 83.1 t -85.76 -40.62 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.46 -0.775 . . . . 0.0 109.984 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 m -69.76 -38.75 76.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -43.65 66.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.268 -0.895 . . . . 0.0 110.131 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.74 -37.51 86.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.397 -0.815 . . . . 0.0 109.939 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.01 -42.51 76.31 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.823 . . . . 0.0 110.022 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.95 -32.2 73.8 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 110.061 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -42.57 84.02 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.332 -0.855 . . . . 0.0 109.933 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -31.14 71.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.327 -0.858 . . . . 0.0 109.91 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -40.96 24.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.065 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.464 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 1.2 tp60 -73.62 -21.79 60.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.432 -0.793 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -83.76 -53.73 5.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.382 -0.824 . . . . 0.0 109.542 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.65 -29.26 51.91 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.313 -0.867 . . . . 0.0 109.102 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -89.91 -35.82 15.38 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.645 -0.659 . . . . 0.0 109.888 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.464 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -68.96 -38.79 79.61 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 110.163 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -78.33 -34.79 48.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.789 . . . . 0.0 110.186 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp85 -59.32 -40.62 86.86 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -0.89 . . . . 0.0 109.835 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.88 -29.33 60.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.47 -0.769 . . . . 0.0 109.779 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.11 -26.98 59.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.427 -0.795 . . . . 0.0 110.076 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.85 -43.96 17.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.392 -0.817 . . . . 0.0 110.148 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.93 -32.99 65.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.31 -0.869 . . . . 0.0 110.11 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -77.04 -44.09 32.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.379 -0.826 . . . . 0.0 110.106 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.24 -28.58 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.12 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.47 26.84 4.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.428 -0.795 . . . . 0.0 110.123 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -145.0 -49.06 0.24 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.3 -0.875 . . . . 0.0 110.013 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -117.55 22.93 12.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.382 -0.823 . . . . 0.0 110.255 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -166.71 41.09 0.26 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.8 tp -64.58 -23.88 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.321 -1.105 . . . . 0.0 110.223 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.72 69.73 1.12 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.305 -0.872 . . . . 0.0 110.166 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.4 p -86.15 135.13 33.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.336 -0.853 . . . . 0.0 110.244 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.9 t -81.52 121.84 26.8 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.398 -0.813 . . . . 0.0 110.291 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.24 -81.62 0.04 OUTLIER Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.394 -1.483 . . . . 0.0 109.394 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.6 p -128.36 92.19 3.39 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.434 -1.039 . . . . 0.0 110.093 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -105.31 67.57 0.78 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.468 -0.77 . . . . 0.0 110.193 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.35 -42.09 14.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.35 -0.844 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 m -92.6 70.88 4.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.343 -0.848 . . . . 0.0 110.126 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -56.75 -29.53 62.65 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.326 -0.859 . . . . 0.0 110.253 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.31 -30.13 57.6 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.222 -0.924 . . . . 0.0 109.119 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.883 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mp -64.99 -29.06 69.96 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 tt -76.44 -37.57 56.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 0.0 109.769 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -83.51 -55.84 4.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.297 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.2 tpt -52.12 -45.35 64.91 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.203 -0.936 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.0 m -66.22 -42.64 88.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.343 -0.848 . . . . 0.0 110.474 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.402 ' O ' ' CB ' ' A' ' 75' ' ' GLU . 4.5 tp -82.78 -6.39 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 0.0 110.368 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -82.26 -46.68 13.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 110.044 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -83.74 -20.88 32.6 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.362 -0.836 . . . . 0.0 110.433 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -88.51 -40.26 13.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.465 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.4 tm-20 -75.3 -36.05 61.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.268 -0.895 . . . . 0.0 110.367 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -64.25 -75.23 0.09 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.311 -0.868 . . . . 0.0 110.201 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.82 -80.87 0.06 OUTLIER Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -154.96 71.61 0.8 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.381 -1.07 . . . . 0.0 110.123 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -53.28 -25.34 14.26 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.401 -0.812 . . . . 0.0 109.775 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.442 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 141.73 -102.42 0.3 Allowed Glycine 0 N--CA 1.487 2.051 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.489 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER 179.61 53.65 0.05 OUTLIER Pre-proline 0 C--N 1.308 -1.213 0 O-C-N 121.547 -0.973 . . . . 0.0 108.959 179.717 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 81' ' ' LEU . 43.1 Cg_endo -69.2 -8.47 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.978 1.515 . . . . 0.0 108.591 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -65.31 83.75 0.05 Allowed 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.164 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mt -81.59 -25.22 35.94 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.444 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.4 m -60.35 -18.85 52.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.31 -0.869 . . . . 0.0 110.671 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.7 m -113.15 22.42 14.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 0.0 110.085 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.2 mtt -102.33 123.12 45.56 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.0 110.173 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 74.7 p -74.55 -166.29 0.43 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 110.38 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.532 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.0 pt-20 -68.61 -28.85 67.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.582 -0.699 . . . . 0.0 109.279 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.403 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 33.6 mt-10 -85.61 -40.68 15.97 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 179.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -64.85 -43.71 92.13 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -66.74 -34.12 77.13 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.532 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.41 -35.75 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -38.44 91.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.486 -0.759 . . . . 0.0 109.485 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.68 -42.54 64.17 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.94 92.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.46 -0.775 . . . . 0.0 110.018 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 34.6 mmm -75.53 -22.41 57.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.419 -0.801 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -49.22 70.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.545 -0.722 . . . . 0.0 109.902 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 31.0 mtm -70.27 -30.96 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.767 . . . . 0.0 110.077 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -25.73 61.99 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.443 -0.786 . . . . 0.0 110.12 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.5 mt -91.75 -9.73 42.59 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.383 -0.823 . . . . 0.0 110.664 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -55.89 -26.1 45.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.366 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.81 38.44 3.09 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -155.92 81.46 1.01 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.324 -1.103 . . . . 0.0 110.219 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -103.95 -47.05 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 110.243 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.34 -68.15 0.93 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.174 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.97 47.47 0.26 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.436 -1.465 . . . . 0.0 109.436 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.94 103.1 6.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.341 -1.093 . . . . 0.0 110.118 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -126.87 43.26 3.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.82 . . . . 0.0 110.213 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.14 28.38 4.06 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.049 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.58 -35.46 4.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.439 -0.788 . . . . 0.0 110.198 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.204 0.526 . . . . 0.0 110.35 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.67 134.42 47.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.409 -0.807 . . . . 0.0 109.555 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 13.2 pt -136.9 155.6 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 109.943 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.408 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 83.3 m-85 -111.64 144.28 41.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.559 -0.713 . . . . 0.0 111.04 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.2 t -127.82 117.77 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.476 -0.765 . . . . 0.0 109.262 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.29 133.95 43.95 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.507 -0.746 . . . . 0.0 110.894 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 72.1 p -96.4 172.08 8.17 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 39.7 mt -61.7 -11.58 12.57 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.405 -0.809 . . . . 0.0 111.017 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.4 p -95.61 0.22 52.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.015 -1.053 . . . . 0.0 110.909 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.46 9.11 67.26 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.5 tttp -84.61 126.09 33.04 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.089 -1.242 . . . . 0.0 109.859 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.0 m -112.97 123.39 50.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.303 -0.873 . . . . 0.0 110.284 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 17.9 mt -109.23 136.58 44.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.534 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.408 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 17.5 m -102.25 119.47 38.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.432 -0.792 . . . . 0.0 109.377 179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.69 162.42 23.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.149 -0.969 . . . . 0.0 111.023 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -106.32 118.89 37.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.542 -0.724 . . . . 0.0 109.262 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.454 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.4 m -140.4 178.65 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.157 -0.964 . . . . 0.0 111.333 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -113.57 159.8 34.1 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -73.69 -24.95 15.25 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 O-C-N 123.403 1.212 . . . . 0.0 110.041 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.8 -4.62 59.15 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.241 -0.912 . . . . 0.0 110.328 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -71.14 144.99 50.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.176 -0.952 . . . . 0.0 110.573 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 71.8 p -83.25 158.24 22.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.484 -0.76 . . . . 0.0 110.329 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.455 HD12 HG23 ' B' ' 23' ' ' ILE . 46.0 mm -59.75 -32.31 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.841 . . . . 0.0 109.505 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.73 -36.96 84.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.421 -0.799 . . . . 0.0 109.251 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.3 -32.01 69.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.506 -0.746 . . . . 0.0 109.162 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.4 t -70.13 -41.18 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.466 -0.771 . . . . 0.0 109.223 179.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -62.96 -41.64 99.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 109.151 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.57 -34.4 75.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.744 . . . . 0.0 109.422 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -68.03 -39.01 83.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.459 179.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.0 mt -66.94 -38.73 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.315 -0.866 . . . . 0.0 109.098 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -49.56 77.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.448 -0.782 . . . . 0.0 109.457 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.24 -27.21 63.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.516 -0.74 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.82 -40.94 18.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.252 -0.905 . . . . 0.0 110.875 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -108.04 -55.78 2.32 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.253 -0.904 . . . . 0.0 110.419 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.08 18.72 1.66 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 80.8 mt -91.38 143.12 27.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.13 -1.217 . . . . 0.0 109.944 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.428 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.8 Cg_endo -69.98 133.73 25.85 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 O-C-N 123.542 1.285 . . . . 0.0 110.492 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.81 -26.69 83.52 Favored 'Trans proline' 0 C--N 1.313 -1.321 0 O-C-N 123.618 1.325 . . . . 0.0 110.949 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.76 -24.25 64.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.357 -0.839 . . . . 0.0 109.968 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.428 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 28.8 mm-40 -101.43 0.59 37.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.288 -0.882 . . . . 0.0 110.441 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -94.38 140.25 30.05 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.14 -0.975 . . . . 0.0 110.447 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -130.14 128.43 41.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.453 -0.779 . . . . 0.0 109.797 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 32.5 mt -104.68 118.97 37.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.322 -0.861 . . . . 0.0 110.522 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 1.6 mp -121.36 135.98 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.506 -0.746 . . . . 0.0 109.922 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -140.83 151.2 44.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.468 -0.77 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.37 28.27 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.511 -0.743 . . . . 0.0 111.195 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.54 1.44 76.64 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.01 137.67 48.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.07 -1.253 . . . . 0.0 110.175 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -78.33 139.13 38.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.258 -0.902 . . . . 0.0 109.998 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.457 HD22 ' CG ' ' B' ' 59' ' ' TYR . 55.1 mt -83.89 143.45 29.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.333 -0.855 . . . . 0.0 110.348 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.62 126.52 38.83 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.505 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.8 p30 -48.69 -29.73 4.75 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.444 -0.785 . . . . 0.0 111.132 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -6.15 88.69 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -99.47 158.6 15.62 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.025 -1.279 . . . . 0.0 110.388 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.5 p -102.06 164.12 11.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.438 -0.789 . . . . 0.0 110.288 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 92.9 mt -53.86 -45.7 71.04 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.341 -0.849 . . . . 0.0 110.751 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 55.4 p -56.58 -34.17 66.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.303 -0.873 . . . . 0.0 111.198 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -59.52 -27.65 66.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.094 -1.004 . . . . 0.0 110.374 -179.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.457 ' CG ' HD22 ' B' ' 50' ' ' LEU . 70.5 m-85 -101.12 27.02 6.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.857 . . . . 0.0 109.983 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.92 32.35 7.28 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.407 HD12 HG22 ' B' ' 61' ' ' ILE . 97.7 mt -81.56 108.91 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.286 -0.884 . . . . 0.0 109.869 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -105.64 173.67 6.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.374 -0.829 . . . . 0.0 110.346 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.4 ptmt -46.62 152.1 0.5 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.59 -0.694 . . . . 0.0 111.17 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.3 mm-40 62.84 15.47 8.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.792 -0.568 . . . . 0.0 110.841 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.64 139.17 49.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -107.37 111.05 23.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.927 . . . . 0.0 110.03 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mp -102.29 164.0 11.92 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.28 -0.888 . . . . 0.0 110.022 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -108.88 130.7 55.43 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 109.996 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 tp -107.19 133.67 51.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.883 . . . . 0.0 110.286 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 27.7 t -124.87 151.59 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.405 -0.809 . . . . 0.0 109.958 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.28 91.46 6.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.319 -0.863 . . . . 0.0 110.274 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -73.38 83.39 1.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.376 -0.828 . . . . 0.0 110.18 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 5.0 mt -88.54 159.18 18.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 110.148 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.3 mmm-85 51.67 55.5 9.27 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.377 -0.827 . . . . 0.0 110.385 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -152.35 -49.56 0.02 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.033 -1.426 . . . . 0.0 109.559 -179.921 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 20.2 p80 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.183 0.516 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mmm -76.93 -178.69 5.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.387 -0.821 . . . . 0.0 110.134 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.15 24.51 12.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.389 -0.819 . . . . 0.0 109.621 179.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.89 -82.19 0.86 Allowed Glycine 0 N--CA 1.487 2.078 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.5 tp -102.8 -32.24 9.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.359 -1.083 . . . . 0.0 110.182 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -94.17 82.14 0.97 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.11 110.02 0.69 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.428 -1.042 . . . . 0.0 110.188 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.0 m 52.17 25.49 3.33 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.31 -0.869 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -101.98 -18.23 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.317 -0.864 . . . . 0.0 110.273 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.4 62.36 1.11 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.309 -0.869 . . . . 0.0 110.131 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.22 92.86 3.88 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.223 -0.923 . . . . 0.0 110.096 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -154.66 -73.34 0.12 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.377 -0.827 . . . . 0.0 110.279 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -129.76 30.85 3.49 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.706 -1.358 . . . . 0.0 109.706 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.3 p -125.14 -36.27 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.278 -1.13 . . . . 0.0 110.321 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -124.22 144.1 44.59 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.296 -0.878 . . . . 0.0 110.147 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 -12.9 29.97 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.696 1.366 . . . . 0.0 110.795 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.5 m -72.65 -7.93 52.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.653 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -86.41 -21.2 27.27 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.47 120.57 0.61 Allowed Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.281 -0.887 . . . . 0.0 109.765 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.31 -15.63 38.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 123.914 1.481 . . . . 0.0 110.129 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -75.52 -31.74 60.25 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.803 . . . . 0.0 109.398 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -83.76 -29.4 27.47 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.601 -0.687 . . . . 0.0 109.361 179.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.69 -37.4 67.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.505 -0.747 . . . . 0.0 109.445 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -78.96 -33.69 45.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.74 -35.23 76.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.42 -0.8 . . . . 0.0 109.841 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.12 -22.67 48.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.452 -0.78 . . . . 0.0 110.088 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.16 -27.25 28.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.332 -0.855 . . . . 0.0 109.45 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 68.5 t -82.4 -45.76 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.52 -0.737 . . . . 0.0 109.795 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -65.75 -41.36 92.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.336 -0.853 . . . . 0.0 110.022 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 tpp -64.17 -48.88 74.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.447 -0.783 . . . . 0.0 110.044 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -61.86 -40.09 94.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.449 -0.782 . . . . 0.0 110.101 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -62.6 -51.34 67.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.388 -0.82 . . . . 0.0 110.058 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -30.11 70.97 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.305 -0.872 . . . . 0.0 109.953 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -44.46 85.07 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.354 -0.841 . . . . 0.0 109.977 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -61.74 -36.55 81.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.356 -0.84 . . . . 0.0 110.055 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -42.6 32.14 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.36 -0.838 . . . . 0.0 109.865 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.426 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 35.3 mm-40 -69.14 -29.71 67.81 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.43 -0.794 . . . . 0.0 110.035 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.96 -57.13 3.32 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.519 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.69 -33.37 47.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.515 -0.741 . . . . 0.0 109.217 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.87 -34.23 24.64 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.577 -0.702 . . . . 0.0 109.14 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.426 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -63.54 -51.51 65.13 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.443 -0.786 . . . . 0.0 109.659 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -64.5 -32.47 74.11 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.342 -0.849 . . . . 0.0 109.673 179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.77 -42.39 68.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.407 -0.808 . . . . 0.0 109.135 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.6 -28.54 45.77 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.2 -29.35 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.535 -0.728 . . . . 0.0 109.636 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.12 -41.77 15.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.05 74.92 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.298 -0.876 . . . . 0.0 110.032 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.5 t -77.96 -34.22 51.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.405 -0.809 . . . . 0.0 110.179 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.24 68.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.167 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.24 -25.49 51.64 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.393 -0.817 . . . . 0.0 110.204 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 93.79 5.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.258 -0.902 . . . . 0.0 110.241 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.52 27.06 4.68 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.25 -0.906 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -103.32 -44.44 1.71 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.2 pt -109.38 38.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.334 -1.098 . . . . 0.0 110.179 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.0 -42.9 13.6 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.253 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.2 p -90.04 57.3 3.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.193 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 t -166.15 145.74 6.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.352 -0.843 . . . . 0.0 110.239 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.46 44.2 0.21 Allowed Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.1 p -130.53 74.92 1.62 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.375 -1.073 . . . . 0.0 110.204 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -87.01 61.38 6.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.269 -0.895 . . . . 0.0 110.178 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.78 -40.47 95.31 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 110.199 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.99 71.73 3.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.416 -0.803 . . . . 0.0 110.148 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -76.81 -55.55 5.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.388 -0.82 . . . . 0.0 110.226 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -74.6 -28.13 60.77 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.183 -0.948 . . . . 0.0 109.161 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.93 97.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.931 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.29 -29.2 69.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.1 tt -75.17 -43.46 52.1 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.482 -0.762 . . . . 0.0 109.891 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.423 -0.798 . . . . 0.0 110.482 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -39.87 61.48 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.144 -0.972 . . . . 0.0 110.671 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.7 m -69.43 -41.31 76.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.299 -0.876 . . . . 0.0 110.453 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.2 tp -82.18 -16.4 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.114 -0.991 . . . . 0.0 110.134 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -74.61 -33.74 62.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.3 -0.875 . . . . 0.0 109.748 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -27.71 23.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.469 -0.77 . . . . 0.0 109.93 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.6 -45.19 11.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.338 -0.851 . . . . 0.0 110.207 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -34.03 69.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.33 -0.856 . . . . 0.0 110.127 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -92.29 47.39 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.41 -0.806 . . . . 0.0 110.172 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.63 -36.01 1.48 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.99 113.31 25.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -1.108 . . . . 0.0 110.273 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.9 m -153.78 27.47 0.49 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.436 -0.79 . . . . 0.0 110.219 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.45 28.01 16.85 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.02 146.95 1.46 Allowed Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.266 -1.137 . . . . 0.0 109.005 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.07 61.27 3.19 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.47 1.247 . . . . 0.0 110.31 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -72.04 89.18 1.11 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.532 -0.73 . . . . 0.0 110.246 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -62.42 -28.54 69.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.422 -0.799 . . . . 0.0 110.142 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.6 m -70.08 -20.94 63.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.416 -0.802 . . . . 0.0 110.39 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -108.85 9.48 26.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.239 -0.913 . . . . 0.0 110.413 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 30.3 mtp -107.23 122.27 46.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.216 -0.927 . . . . 0.0 110.038 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.1 p -77.31 -165.05 0.53 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.465 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.575 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.9 pt-20 -67.14 -31.29 71.63 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.543 -0.723 . . . . 0.0 109.175 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.419 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.9 OUTLIER -85.48 -40.75 16.03 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -42.56 99.75 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -69.8 -35.92 75.24 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 178.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.575 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.76 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.798 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.67 72.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.541 -0.724 . . . . 0.0 109.802 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.21 -52.7 7.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.481 -0.762 . . . . 0.0 110.09 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.0 -33.09 74.94 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.4 -0.812 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.2 ttm -80.2 -21.52 42.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 109.824 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -73.69 -29.65 62.41 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.422 -0.799 . . . . 0.0 110.071 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.8 -28.59 21.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.464 -0.773 . . . . 0.0 110.184 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.78 -31.65 61.82 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.858 . . . . 0.0 110.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.42 14.28 17.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.436 -0.79 . . . . 0.0 110.41 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.62 -25.98 50.22 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.209 -0.932 . . . . 0.0 110.17 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 117.84 38.37 0.83 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -77.06 65.68 2.74 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.36 -1.082 . . . . 0.0 110.198 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.22 -38.22 43.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.151 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -162.55 55.37 0.22 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.455 -0.778 . . . . 0.0 110.065 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.34 85.72 0.71 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -151.39 96.5 2.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.373 -1.074 . . . . 0.0 110.226 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.55 44.31 0.08 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.341 -0.85 . . . . 0.0 110.161 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -124.37 53.91 1.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.378 -0.826 . . . . 0.0 110.179 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.9 t -132.66 15.48 4.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.301 -0.875 . . . . 0.0 110.473 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.182 179.959 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.26 0.552 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -97.24 145.38 26.12 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.502 -0.749 . . . . 0.0 109.903 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 12.7 pt -137.65 159.47 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.344 -0.848 . . . . 0.0 110.17 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -111.85 142.82 43.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.582 -0.699 . . . . 0.0 110.754 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -127.76 118.16 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.476 -0.765 . . . . 0.0 109.503 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -100.25 135.19 42.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 110.607 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -96.04 170.04 9.56 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.454 -0.779 . . . . 0.0 110.189 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 8.3 mt -61.82 -9.27 6.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.459 -0.776 . . . . 0.0 111.203 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.9 p -95.27 -13.34 24.94 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.081 -1.012 . . . . 0.0 110.564 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 6.16 40.26 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.238 -1.145 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -84.61 128.56 34.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.113 -1.228 . . . . 0.0 110.049 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.8 m -113.23 125.21 54.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.303 -0.873 . . . . 0.0 110.08 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.4 mt -109.12 135.13 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.439 -0.788 . . . . 0.0 110.522 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.1 m -102.43 118.0 35.93 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.516 -0.74 . . . . 0.0 109.26 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -123.38 166.45 15.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.156 -0.965 . . . . 0.0 110.821 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.5 115.11 29.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.441 -0.787 . . . . 0.0 109.528 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 21.5 m -140.51 170.26 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.282 -0.886 . . . . 0.0 110.823 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -112.7 164.62 14.95 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.586 -0.696 . . . . 0.0 109.185 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -70.94 -25.51 23.04 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.569 1.3 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.36 -3.93 58.58 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.444 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -71.31 143.6 50.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.559 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.6 p -83.21 156.66 23.06 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.547 -0.72 . . . . 0.0 110.446 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.454 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 31.4 mm -59.67 -34.77 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.383 -0.823 . . . . 0.0 109.616 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.74 -36.92 82.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.34 -0.85 . . . . 0.0 109.33 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.2 -32.21 70.02 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.353 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.36 -39.2 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.451 -0.78 . . . . 0.0 109.049 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -63.14 -43.78 97.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.103 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.05 73.13 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.463 -0.773 . . . . 0.0 109.469 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.6 mttm -68.07 -40.26 82.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.495 -0.753 . . . . 0.0 109.543 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 18.0 mt -67.1 -37.14 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.586 -0.845 . . . . 0.0 109.03 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -60.83 -52.72 63.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.474 -0.767 . . . . 0.0 109.644 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -27.46 63.7 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.712 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -84.0 -39.93 19.07 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.198 -0.939 . . . . 0.0 111.037 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -108.15 -54.19 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.278 -0.889 . . . . 0.0 110.512 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.81 16.64 2.19 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.264 -1.135 . . . . 0.0 110.264 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 93.5 mt -91.2 143.51 28.48 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.077 -1.249 . . . . 0.0 109.778 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.443 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.1 Cg_endo -69.49 133.88 27.17 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.66 1.347 . . . . 0.0 110.556 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.83 -26.43 83.05 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.741 1.39 . . . . 0.0 110.81 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.78 -25.65 64.81 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.341 -0.85 . . . . 0.0 109.902 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 58.8 mm-40 -101.26 4.36 41.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.35 -0.844 . . . . 0.0 110.464 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.22 139.32 31.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.238 -0.914 . . . . 0.0 110.468 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -130.17 126.4 37.35 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.473 -0.767 . . . . 0.0 109.783 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 13.7 mt -104.64 117.91 35.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.251 -0.905 . . . . 0.0 110.376 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 2.0 mp -121.35 138.06 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.513 -0.742 . . . . 0.0 109.92 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' B' ' 46' ' ' ALA . 66.8 t80 -140.7 147.88 39.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.567 -0.708 . . . . 0.0 109.753 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.426 ' HB3' ' CD2' ' B' ' 45' ' ' PHE . . . 45.42 28.8 0.51 Allowed 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.416 -0.803 . . . . 0.0 111.189 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.8 3.75 87.69 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.85 133.69 53.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.083 -1.245 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -78.49 134.3 37.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.064 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.452 HD23 ' CE2' ' B' ' 59' ' ' TYR . 39.9 mt -84.27 140.31 31.74 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.385 -0.822 . . . . 0.0 110.28 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -93.67 130.49 39.59 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.406 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.454 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.2 m-20 -48.43 -26.75 2.25 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.433 -0.792 . . . . 0.0 111.202 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.96 -8.05 86.33 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.702 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.459 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.34 159.04 15.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.01 -1.288 . . . . 0.0 110.432 -179.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.1 p -102.08 162.98 12.49 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.396 -0.815 . . . . 0.0 110.182 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 82.0 mt -53.45 -43.98 68.53 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.295 -0.878 . . . . 0.0 110.669 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.9 -34.72 68.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.413 -0.804 . . . . 0.0 111.131 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.5 -26.96 65.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.11 -0.994 . . . . 0.0 110.394 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.459 ' CE2' ' HB3' ' B' ' 54' ' ' ARG . 53.2 m-85 -101.15 26.21 7.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 110.053 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m120 50.63 31.06 5.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.541 -0.724 . . . . 0.0 110.728 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.446 HD13 HG23 ' B' ' 61' ' ' ILE . 88.5 mt -81.41 114.53 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.86 . . . . 0.0 109.784 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -105.55 167.86 9.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.384 -0.823 . . . . 0.0 110.219 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.9 pttt -46.54 153.13 0.39 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.479 -0.763 . . . . 0.0 111.041 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 21.0 mt-10 63.4 14.01 7.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.766 -0.584 . . . . 0.0 110.818 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.83 144.62 49.05 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.157 -0.964 . . . . 0.0 110.225 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.0 m -107.51 110.9 22.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.331 -0.856 . . . . 0.0 109.818 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.7 mt -102.38 165.03 11.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.252 -0.905 . . . . 0.0 110.344 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -108.82 129.53 55.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.358 -0.839 . . . . 0.0 110.125 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -107.34 131.24 54.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.1 t -124.89 154.3 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.423 -0.798 . . . . 0.0 110.18 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 39.0 mt -94.44 110.21 22.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.375 -0.828 . . . . 0.0 110.219 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -84.82 87.84 7.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.864 . . . . 0.0 110.159 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 4.7 mt -97.12 129.93 44.46 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.18 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -162.12 83.24 0.57 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.411 -0.806 . . . . 0.0 110.155 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -113.33 67.47 0.25 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.97 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . 0.446 ' O ' ' N ' ' A' ' 3' ' ' LEU . 47.4 t-80 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.142 0.496 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.578 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 66.18 -64.67 0.21 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.571 -0.706 . . . . 0.0 110.657 179.995 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.578 ' CB ' ' O ' ' A' ' 2' ' ' MET . 0.9 OUTLIER 81.8 34.96 0.08 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.875 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.11 -30.98 58.21 Favored Glycine 0 N--CA 1.481 1.688 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -75.7 -39.35 57.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -1.1 . . . . 0.0 110.239 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.02 -146.75 2.32 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 56.21 102.32 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.363 -1.08 . . . . 0.0 110.6 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m 67.0 -64.0 0.26 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.547 -0.721 . . . . 0.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' O ' ' CG ' ' A' ' 10' ' ' PHE . 1.1 m-20 -51.81 -27.64 13.05 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.294 -0.879 . . . . 0.0 110.442 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.401 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 28.6 m-85 -156.51 105.04 2.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.452 -0.78 . . . . 0.0 110.153 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -157.73 34.16 0.26 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.307 -0.871 . . . . 0.0 110.295 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -132.73 -53.04 0.93 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.349 -0.845 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -114.42 29.2 7.74 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.3 p -125.51 -34.09 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -1.038 . . . . 0.0 110.402 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -129.48 126.74 22.92 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.304 -0.872 . . . . 0.0 110.15 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -70.69 -10.7 28.35 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.599 1.315 . . . . 0.0 110.859 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 52.7 p -69.87 -11.25 60.72 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.195 -0.941 . . . . 0.0 110.457 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.31 -26.62 26.45 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.227 -0.92 . . . . 0.0 110.276 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -168.31 117.09 0.63 Allowed Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.39 -14.59 34.23 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 124.013 1.533 . . . . 0.0 110.094 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HB3' ' CG1' ' B' ' 70' ' ' VAL . 0.1 OUTLIER -74.39 -31.67 62.44 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.455 -0.778 . . . . 0.0 109.358 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.11 -30.87 25.61 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.62 -35.57 77.49 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.152 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.78 -34.58 52.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.73 . . . . 0.0 109.492 179.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.24 -31.02 72.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.472 -0.767 . . . . 0.0 109.969 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.6 -25.56 33.09 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.377 -0.827 . . . . 0.0 110.125 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -83.78 -28.98 27.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.605 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 64.3 t -80.84 -28.36 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.919 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -78.43 -45.2 22.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.475 -0.766 . . . . 0.0 110.128 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.6 tpt -64.81 -39.19 93.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.401 -0.812 . . . . 0.0 110.043 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -68.83 -32.23 71.77 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.452 -0.78 . . . . 0.0 110.228 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.25 -48.24 62.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.346 -0.846 . . . . 0.0 110.115 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -29.71 66.89 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.348 -0.845 . . . . 0.0 110.164 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -44.65 63.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -29.13 66.2 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.332 -0.855 . . . . 0.0 110.356 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -81.02 -47.25 13.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.324 -0.86 . . . . 0.0 110.134 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.411 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.8 OUTLIER -75.1 -19.91 59.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.324 -0.86 . . . . 0.0 110.194 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -83.76 -58.89 2.61 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.691 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -52.29 -33.81 43.87 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.428 -0.795 . . . . 0.0 109.294 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -81.35 -35.17 31.22 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.411 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -63.85 -52.76 58.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.537 -0.727 . . . . 0.0 109.562 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 14.6 ptt85 -68.59 -30.63 69.42 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.389 -0.819 . . . . 0.0 109.65 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.2 mmm180 -53.13 -40.63 64.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.431 -0.793 . . . . 0.0 109.396 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.58 -27.75 37.35 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.547 -0.721 . . . . 0.0 109.093 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.82 -29.93 70.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.557 -0.715 . . . . 0.0 109.799 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.26 -50.04 6.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.5 67.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.38 -0.825 . . . . 0.0 110.07 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.3 p -88.17 -45.76 9.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.393 -0.817 . . . . 0.0 110.146 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.84 -30.31 71.4 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.444 -0.785 . . . . 0.0 110.233 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.59 -32.58 72.69 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.38 -0.825 . . . . 0.0 110.104 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -114.44 47.12 1.27 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.403 -0.81 . . . . 0.0 110.189 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -168.23 -53.71 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.307 -0.871 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.65 -32.43 57.38 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.1 tp -123.04 83.57 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -1.11 . . . . 0.0 110.248 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -116.6 90.25 3.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.243 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.5 t -64.78 119.11 10.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.389 -0.819 . . . . 0.0 110.233 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 28.7 m -109.2 50.14 0.79 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.351 -0.843 . . . . 0.0 110.274 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -149.1 -128.83 1.72 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.0 t -161.36 70.02 0.35 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -1.061 . . . . 0.0 110.176 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.13 61.96 1.35 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.356 -0.84 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 -54.92 0.2 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.171 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -109.79 75.2 0.93 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.431 -0.793 . . . . 0.0 110.116 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.47 -47.99 24.65 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.27 -0.894 . . . . 0.0 110.364 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.18 -28.89 61.51 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.243 -0.91 . . . . 0.0 109.075 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.47 96.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.939 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.4 tp -65.08 -28.35 69.4 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.45 -48.35 34.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.535 -0.728 . . . . 0.0 109.563 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.63 -52.95 7.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 110.545 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 tpt -51.73 -38.78 56.77 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.232 -0.917 . . . . 0.0 110.824 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.3 m -71.11 -40.65 71.33 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.264 -0.898 . . . . 0.0 110.396 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 tp -83.65 -13.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.973 . . . . 0.0 110.226 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -76.28 -48.43 20.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.293 -0.88 . . . . 0.0 109.784 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -25.41 47.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 110.064 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -81.72 -47.69 12.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.831 . . . . 0.0 110.223 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.29 -44.19 97.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.286 -0.883 . . . . 0.0 110.155 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -83.67 90.32 7.27 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.458 -0.776 . . . . 0.0 110.153 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.53 -41.4 0.04 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.539 -1.425 . . . . 0.0 109.539 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.93 88.56 7.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.384 -1.068 . . . . 0.0 110.198 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -153.12 90.34 1.43 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.423 -0.798 . . . . 0.0 110.136 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -135.64 47.92 0.95 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.18 149.16 1.69 Allowed Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.37 -1.076 . . . . 0.0 108.911 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -72.12 63.38 3.39 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 123.51 1.269 . . . . 0.0 110.535 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 p-10 -71.1 70.21 0.53 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.183 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.13 -29.33 61.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.117 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -64.56 -19.54 65.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.358 -0.839 . . . . 0.0 110.419 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.4 t -102.49 -19.05 15.05 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.606 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.6 mtp -88.98 129.79 35.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.191 -0.943 . . . . 0.0 110.301 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 75.4 p -79.48 -163.75 0.55 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.449 -0.782 . . . . 0.0 110.496 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.544 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -67.24 -31.83 72.44 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.477 -0.764 . . . . 0.0 109.248 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.411 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 27.3 mt-10 -85.44 -40.61 16.22 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -63.89 -42.26 97.52 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.1 -35.39 76.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.544 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.31 -36.83 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.87 -29.76 69.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 109.616 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -83.82 -38.51 21.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.466 -0.772 . . . . 0.0 110.057 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -79.57 -28.98 41.12 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.329 -0.857 . . . . 0.0 110.469 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -83.96 -31.83 25.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.3 -0.875 . . . . 0.0 109.73 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -73.03 -29.37 62.94 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.505 -0.747 . . . . 0.0 110.008 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.36 -21.26 22.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.426 -0.796 . . . . 0.0 110.269 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.43 -57.53 3.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.213 -0.929 . . . . 0.0 110.373 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.3 pp -61.74 -28.16 69.23 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.278 -0.889 . . . . 0.0 110.272 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -61.69 -55.37 31.13 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.404 -0.81 . . . . 0.0 110.171 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.78 132.96 4.46 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -150.89 70.51 1.0 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.374 -1.074 . . . . 0.0 110.157 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -116.43 -57.06 2.24 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.342 -0.849 . . . . 0.0 110.128 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -115.61 69.49 0.73 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.428 -0.795 . . . . 0.0 110.16 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -83.8 124.28 6.55 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.73 57.9 1.38 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.333 -1.098 . . . . 0.0 110.258 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.97 -66.09 0.95 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.36 -0.838 . . . . 0.0 110.186 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 51.9 56.86 7.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.405 -0.81 . . . . 0.0 110.433 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -138.77 64.81 1.47 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.169 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.262 179.971 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.43 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.4 ttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.303 0.573 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -112.96 140.19 47.97 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.374 -0.829 . . . . 0.0 109.606 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 43.2 pt -137.72 157.15 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.212 -0.93 . . . . 0.0 110.535 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -111.89 144.89 40.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.598 -0.689 . . . . 0.0 110.546 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 68.4 t -128.13 122.38 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.342 -0.849 . . . . 0.0 109.603 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 12.0 mttt -100.16 131.98 45.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.689 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.4 p -95.79 175.71 6.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.431 -0.793 . . . . 0.0 109.921 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 22.1 mt -61.57 -12.77 16.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.309 -0.869 . . . . 0.0 111.17 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.2 p -95.73 14.5 22.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.007 -1.058 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.84 8.34 68.1 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -84.79 134.02 34.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.066 -1.256 . . . . 0.0 109.913 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.3 m -113.26 130.28 56.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -0.881 . . . . 0.0 110.318 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 mt -109.15 141.89 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.401 -0.812 . . . . 0.0 110.239 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 8.5 m -101.84 121.94 43.05 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.441 -0.787 . . . . 0.0 109.504 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.6 mt -123.27 156.27 35.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.16 -0.963 . . . . 0.0 110.831 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 113.95 27.79 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.422 -0.798 . . . . 0.0 109.422 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.43 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.2 m -139.9 178.46 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.309 -0.869 . . . . 0.0 110.856 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -113.01 166.14 11.7 Favored Pre-proline 0 N--CA 1.489 1.492 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.27 -28.86 14.81 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.469 1.247 . . . . 0.0 110.277 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.44 -0.68 53.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.63 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -71.21 142.71 50.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.38 159.51 21.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.537 -0.727 . . . . 0.0 110.498 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.437 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 44.1 mm -59.71 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.363 -0.836 . . . . 0.0 109.565 179.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -36.88 74.74 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.385 -0.822 . . . . 0.0 109.425 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -70.06 -31.17 68.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.495 -0.753 . . . . 0.0 109.208 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -70.24 -39.89 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 119.839 -0.745 . . . . 0.0 109.134 179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -63.26 -43.05 99.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.502 -0.749 . . . . 0.0 109.178 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.9 76.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.502 -0.749 . . . . 0.0 109.49 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -68.12 -38.32 82.09 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.501 -0.749 . . . . 0.0 109.491 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.19 -39.73 83.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.415 -0.803 . . . . 0.0 109.111 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' B' ' 35' ' ' GLY . 13.9 tt0 -60.61 -47.86 84.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.301 -0.875 . . . . 0.0 109.299 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -58.01 -27.76 63.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.407 -0.808 . . . . 0.0 110.241 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.9 mmtm -84.27 -41.26 17.06 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.399 -0.813 . . . . 0.0 110.874 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -107.76 -55.79 2.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.248 -0.907 . . . . 0.0 110.365 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.8 21.27 1.77 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.414 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 56.8 mt -91.65 144.4 29.44 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.197 -1.178 . . . . 0.0 109.976 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.415 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.1 Cg_endo -68.51 131.83 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.536 1.282 . . . . 0.0 110.622 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.96 -24.61 79.87 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.653 1.344 . . . . 0.0 110.714 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.61 -25.4 64.84 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.829 . . . . 0.0 109.731 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.415 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 4.4 mt-30 -101.33 0.1 36.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.49 -0.756 . . . . 0.0 110.425 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -94.44 137.22 33.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.201 -0.937 . . . . 0.0 110.475 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.22 134.69 47.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.454 -0.779 . . . . 0.0 109.765 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 18.0 mt -104.67 116.59 32.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.217 -0.927 . . . . 0.0 110.333 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.417 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.2 mp -121.21 135.14 62.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.463 -0.773 . . . . 0.0 109.831 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -140.69 145.98 37.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.338 -0.851 . . . . 0.0 109.767 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.66 28.93 0.59 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.741 . . . . 0.0 110.932 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.56 5.1 88.02 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -111.03 128.71 55.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.166 -1.197 . . . . 0.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 132.48 37.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 109.589 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.439 ' CD2' ' CG ' ' B' ' 59' ' ' TYR . 48.9 mt -83.74 142.96 30.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.223 -0.923 . . . . 0.0 110.274 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -93.5 133.12 37.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.486 -0.759 . . . . 0.0 110.442 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.437 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 65.9 m-20 -48.54 -28.18 3.22 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.565 -0.709 . . . . 0.0 111.027 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -5.85 88.81 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 120.116 -1.04 . . . . 0.0 110.692 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.43 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 11.2 mmt180 -99.51 153.57 18.92 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.027 -1.278 . . . . 0.0 110.488 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.6 p -102.23 165.63 11.03 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.291 -0.881 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 87.8 mt -53.6 -45.66 70.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.29 -0.881 . . . . 0.0 110.78 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -56.82 -38.39 72.54 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.432 -0.792 . . . . 0.0 110.958 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -59.68 -27.93 66.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.325 -0.86 . . . . 0.0 110.425 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.439 ' CG ' ' CD2' ' B' ' 50' ' ' LEU . 40.8 m-85 -100.98 26.72 6.67 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.954 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 50.69 27.39 2.97 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.569 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.452 HG23 HD11 ' B' ' 61' ' ' ILE . 88.0 mt -81.37 109.46 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.377 -0.827 . . . . 0.0 109.79 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.54 172.11 6.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.426 -0.796 . . . . 0.0 110.164 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.44 152.73 0.42 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.547 -0.721 . . . . 0.0 111.084 -179.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.7 mm-40 63.0 16.55 9.37 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.81 -0.556 . . . . 0.0 110.595 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.63 145.66 48.82 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.3 m -107.91 108.05 19.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 10.3 mt -102.54 157.96 16.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.29 -0.881 . . . . 0.0 110.091 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -108.88 138.52 45.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.254 -0.904 . . . . 0.0 109.995 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 45.9 tp -106.95 133.16 52.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.349 -0.845 . . . . 0.0 110.276 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.402 ' CG1' ' HB3' ' A' ' 21' ' ' GLU . 61.5 t -125.01 158.14 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 110.405 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 12.5 mt -94.26 121.44 35.78 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.312 -0.867 . . . . 0.0 110.251 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.23 101.76 13.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.351 -0.843 . . . . 0.0 110.164 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 mp -104.86 178.19 4.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.342 -0.849 . . . . 0.0 110.325 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.62 95.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.391 -0.818 . . . . 0.0 110.558 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -92.54 163.93 27.68 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.037 -1.424 . . . . 0.0 109.578 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.2 t60 . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.15 0.5 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtp -62.08 -177.17 0.11 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.825 . . . . 0.0 110.195 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.71 24.48 12.41 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.438 -0.789 . . . . 0.0 109.689 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.55 -102.19 0.09 OUTLIER Glycine 0 N--CA 1.488 2.165 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mt -128.26 -62.94 1.02 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.383 -1.069 . . . . 0.0 110.139 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.37 -164.87 19.48 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.6 32.97 5.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.332 -1.099 . . . . 0.0 110.17 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -146.75 21.69 1.28 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.422 -0.799 . . . . 0.0 110.326 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.96 -18.0 15.87 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.316 -0.865 . . . . 0.0 110.177 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 27.0 p90 -161.99 45.67 0.16 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.341 -0.849 . . . . 0.0 110.133 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.03 68.93 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.536 -0.727 . . . . 0.0 110.107 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 52.32 25.07 3.19 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.285 -0.884 . . . . 0.0 110.519 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -117.8 35.4 4.09 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.1 t -143.57 -64.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -1.071 . . . . 0.0 110.166 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.522 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.4 OUTLIER -166.36 -178.75 0.73 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.483 -0.761 . . . . 0.0 109.577 -179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.522 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 37.2 Cg_endo -61.33 78.27 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.486 1.256 . . . . 0.0 111.028 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.455 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 69.6 44.63 0.87 Allowed 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.7 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.49 25.25 0.07 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.27 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -170.15 112.78 0.47 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.133 -0.979 . . . . 0.0 110.342 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.23 -14.37 28.52 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.932 1.49 . . . . 0.0 109.828 179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -75.75 -35.94 60.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.439 -0.788 . . . . 0.0 109.444 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.6 mt -78.09 -30.23 49.47 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.416 ' CB ' ' HB2' ' A' ' 16' ' ' PRO . . . -70.14 -36.63 74.91 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 0.0 109.175 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 29.7 tp -77.31 -30.41 54.1 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.631 -0.668 . . . . 0.0 109.362 179.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -38.44 91.15 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.321 -0.862 . . . . 0.0 109.729 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 68.2 tp -80.39 -22.13 41.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.466 -0.771 . . . . 0.0 110.194 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.02 -28.94 35.24 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.3 -0.875 . . . . 0.0 109.207 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.2 t -79.69 -28.72 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 121.631 -0.668 . . . . 0.0 109.589 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.8 p -74.28 -43.37 57.17 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.536 -0.727 . . . . 0.0 110.01 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.9 mmt -68.6 -31.22 70.24 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.423 -0.798 . . . . 0.0 110.207 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.6 -33.45 64.61 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.344 -0.847 . . . . 0.0 110.104 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -69.9 -45.48 67.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.835 . . . . 0.0 110.126 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -65.65 -36.13 82.79 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.4 -0.812 . . . . 0.0 110.268 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.48 -43.01 81.99 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.382 -0.824 . . . . 0.0 110.098 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -58.98 -41.86 88.6 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.285 -0.885 . . . . 0.0 110.323 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -78.35 -39.84 38.23 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.373 -0.829 . . . . 0.0 110.279 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.455 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 32.4 mt-30 -73.68 -24.18 59.93 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -77.24 -55.04 5.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 109.477 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -53.26 -32.17 47.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.344 -0.847 . . . . 0.0 109.073 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -87.11 -34.52 19.08 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.695 -0.628 . . . . 0.0 109.499 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -67.22 -50.95 58.86 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.361 -0.837 . . . . 0.0 110.017 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -66.8 -36.06 81.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 110.395 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -57.1 -37.81 72.47 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.342 -0.849 . . . . 0.0 110.133 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.84 -26.13 37.24 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.436 -0.79 . . . . 0.0 109.916 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.29 59.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.398 -0.814 . . . . 0.0 109.989 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.32 -38.26 20.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.219 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.33 -33.07 74.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.345 -0.847 . . . . 0.0 110.158 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -80.04 -31.23 39.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.385 -0.822 . . . . 0.0 110.182 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.85 95.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.351 -0.843 . . . . 0.0 110.168 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.24 -21.16 56.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.321 -0.862 . . . . 0.0 110.352 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -55.38 -24.37 29.47 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.285 -0.884 . . . . 0.0 110.522 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -109.74 -25.59 10.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.205 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.16 67.1 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 13.8 tt -108.25 77.13 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.295 -1.12 . . . . 0.0 110.257 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -164.67 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.229 -0.919 . . . . 0.0 110.239 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.3 p -139.89 52.35 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.375 -0.828 . . . . 0.0 110.263 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 p -124.91 -60.21 1.38 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.382 -0.824 . . . . 0.0 110.288 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -148.6 39.21 0.97 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.3 p -80.76 76.44 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.269 -1.136 . . . . 0.0 110.269 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -91.53 55.79 2.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.257 -0.902 . . . . 0.0 110.174 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.98 -32.31 61.65 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.319 -0.863 . . . . 0.0 110.225 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.89 73.27 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.43 -0.794 . . . . 0.0 110.088 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.49 -38.02 74.29 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -75.1 -28.92 60.45 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.246 -0.909 . . . . 0.0 109.145 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.92 97.66 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.685 -0.806 . . . . 0.0 108.869 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -28.62 69.44 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -75.69 -45.78 34.95 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.598 -0.688 . . . . 0.0 109.869 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.1 OUTLIER -80.01 -53.51 6.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.484 -0.76 . . . . 0.0 110.487 -179.851 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.92 -40.37 60.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.139 -0.976 . . . . 0.0 110.643 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.2 m -69.43 -41.17 76.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.259 -0.9 . . . . 0.0 110.423 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.0 tp -85.38 -10.62 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.076 -1.015 . . . . 0.0 110.466 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 30.3 t -80.32 -36.27 34.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.717 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -89.25 -23.87 22.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.54 -0.725 . . . . 0.0 110.067 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -89.84 -40.71 12.26 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.344 -0.847 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.12 -33.41 26.31 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.303 -0.873 . . . . 0.0 110.181 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -118.97 45.7 2.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.303 -0.873 . . . . 0.0 110.245 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -119.18 -51.33 0.29 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 106.36 18.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.356 -1.084 . . . . 0.0 110.124 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.2 m -153.02 30.64 0.49 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.45 -0.781 . . . . 0.0 110.285 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.93 36.19 4.03 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.516 -1.433 . . . . 0.0 109.516 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.47 142.58 8.46 Favored Pre-proline 0 C--N 1.307 -1.265 0 O-C-N 121.393 -1.063 . . . . 0.0 108.911 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -74.72 50.52 2.44 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 123.52 1.274 . . . . 0.0 110.441 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.65 98.82 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.921 . . . . 0.0 110.198 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.4 -24.79 14.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.316 -0.865 . . . . 0.0 110.262 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.38 -28.04 57.98 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.394 -0.816 . . . . 0.0 110.292 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.99 -21.38 18.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.351 -0.843 . . . . 0.0 110.285 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.1 mtt -71.37 122.06 19.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.263 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.486 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.7 p -73.1 -162.32 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.47 -0.769 . . . . 0.0 110.367 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.548 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.9 pt-20 -69.49 -29.45 67.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.511 -0.743 . . . . 0.0 109.365 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.7 OUTLIER -84.7 -38.41 19.77 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.486 ' HB2' ' N ' ' A' ' 88' ' ' THR . 10.0 mm-40 -66.52 -43.77 84.29 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -66.6 -35.39 80.09 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.548 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.8 -35.74 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.703 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.2 -38.84 92.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.622 -0.674 . . . . 0.0 109.402 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -44.89 59.23 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.508 -0.745 . . . . 0.0 109.95 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.77 82.16 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.414 -0.804 . . . . 0.0 110.019 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 20.5 mmt -79.32 -24.64 42.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.31 -0.869 . . . . 0.0 109.628 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -65.88 -44.39 85.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 0.0 109.991 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 41.4 mtp -76.18 -26.13 55.91 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.364 -0.835 . . . . 0.0 110.08 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 39.5 t -73.52 -29.04 62.22 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.406 -0.809 . . . . 0.0 110.086 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mp -87.86 7.34 31.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.32 -0.862 . . . . 0.0 110.466 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -68.15 -35.03 77.41 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.203 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.9 23.58 55.18 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -169.7 64.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.25 -1.147 . . . . 0.0 110.174 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -86.53 -38.42 17.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.843 . . . . 0.0 110.144 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -88.23 -20.69 25.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.37 -0.831 . . . . 0.0 110.352 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.08 92.52 0.05 OUTLIER Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.66 66.84 1.25 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.405 -1.056 . . . . 0.0 110.05 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -164.83 115.49 1.16 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.283 -0.886 . . . . 0.0 110.216 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -128.02 91.83 3.34 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.326 -0.859 . . . . 0.0 110.259 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 56.8 p -130.76 -174.85 3.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.276 -0.89 . . . . 0.0 110.236 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.169 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.446 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.4 ttp . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.241 0.543 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -88.09 140.78 29.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.0 109.717 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 35.3 pt -137.37 157.65 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.257 -0.902 . . . . 0.0 110.259 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.8 144.31 41.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.654 -0.654 . . . . 0.0 110.598 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.3 t -128.16 126.02 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 109.659 179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -99.81 138.45 36.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.285 -0.885 . . . . 0.0 110.636 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 74.2 p -95.85 171.56 8.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.479 -0.763 . . . . 0.0 110.481 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.424 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.34 -14.05 24.16 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -0.813 . . . . 0.0 111.164 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.2 p -95.6 -23.6 16.97 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.092 -1.005 . . . . 0.0 110.75 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.59 10.94 8.98 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? -84.57 137.42 33.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.268 . . . . 0.0 109.797 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.0 m -113.12 126.31 55.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.291 -0.881 . . . . 0.0 110.306 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 mt -108.96 136.3 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.411 -0.806 . . . . 0.0 110.255 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.4 m -101.85 121.09 41.45 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 109.319 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mt -123.3 159.37 28.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.192 -0.943 . . . . 0.0 110.858 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -106.35 113.71 27.39 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.183 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.446 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.8 m -140.19 174.34 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.331 -0.856 . . . . 0.0 110.951 -178.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -112.9 165.41 13.19 Favored Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.92 -26.97 18.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.525 1.276 . . . . 0.0 110.326 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.39 -2.63 57.46 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 110.522 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.58 142.28 50.03 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 65.8 p -83.41 160.5 21.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.704 . . . . 0.0 110.485 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.431 HG23 HD13 ' B' ' 23' ' ' ILE . 42.0 mm -59.64 -35.64 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.619 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.86 -35.88 75.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.197 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -32.21 69.53 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.536 -0.728 . . . . 0.0 109.29 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 72.4 t -69.96 -42.84 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.499 -0.751 . . . . 0.0 109.387 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -62.88 -40.69 98.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.466 -0.771 . . . . 0.0 109.324 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -36.46 81.03 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.682 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -68.15 -38.12 81.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 0.0 109.688 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.414 HD13 HG22 ' B' ' 30' ' ' ILE . 11.5 mt -67.02 -39.59 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.374 -0.829 . . . . 0.0 109.119 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.2 tm0? -60.48 -48.89 79.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.429 -0.794 . . . . 0.0 109.422 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.08 -26.55 62.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.787 . . . . 0.0 110.25 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -84.07 -39.97 18.9 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -108.03 -55.97 2.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.316 -0.865 . . . . 0.0 110.622 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.02 15.7 2.29 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.412 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 60.7 mt -91.38 144.62 29.99 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.134 -1.215 . . . . 0.0 109.849 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.462 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -69.77 134.64 28.45 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.546 1.287 . . . . 0.0 110.454 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -61.02 -26.59 83.34 Favored 'Trans proline' 0 C--N 1.312 -1.376 0 O-C-N 123.793 1.417 . . . . 0.0 111.152 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.92 -19.67 64.2 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.26 -0.9 . . . . 0.0 110.228 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.462 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.4 mp0 -100.98 -9.42 21.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 110.753 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -94.35 145.7 24.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.166 -0.959 . . . . 0.0 110.873 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.6 ttt85 -130.18 134.25 47.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.514 -0.742 . . . . 0.0 109.522 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 25.8 mt -104.34 117.54 34.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.423 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.408 ' CD1' ' N ' ' B' ' 44' ' ' ILE . 2.1 mp -121.2 133.68 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.633 -0.667 . . . . 0.0 109.742 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.419 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 28.4 t80 -140.63 151.44 44.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.454 -0.779 . . . . 0.0 109.902 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.419 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.42 27.41 0.37 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.491 -0.756 . . . . 0.0 111.243 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.81 -0.82 81.16 Favored Glycine 0 N--CA 1.495 2.594 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.605 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.87 136.0 50.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.069 -1.254 . . . . 0.0 110.275 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.5 137.06 37.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.88 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.431 HD21 ' CZ ' ' B' ' 59' ' ' TYR . 39.5 mt -84.1 139.9 32.16 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.0 110.324 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -93.61 134.71 35.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.306 -0.871 . . . . 0.0 110.465 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.411 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.7 p-10 -48.6 -30.89 5.84 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.495 -0.753 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.01 -4.02 90.18 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.405 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 23.6 mmt180 -99.63 153.54 18.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.053 -1.263 . . . . 0.0 110.652 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 78.4 p -102.33 163.42 12.24 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.333 -0.854 . . . . 0.0 110.222 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 71.9 mt -53.52 -43.87 68.68 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.223 -0.923 . . . . 0.0 110.616 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 85.8 p -56.67 -37.33 70.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.389 -0.819 . . . . 0.0 111.051 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.44 -26.46 65.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.185 -0.947 . . . . 0.0 110.354 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.431 ' CZ ' HD21 ' B' ' 50' ' ' LEU . 70.0 m-85 -101.24 25.11 8.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.177 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t30 50.52 29.21 3.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.477 -0.764 . . . . 0.0 110.726 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.416 HG23 HD11 ' B' ' 61' ' ' ILE . 94.1 mt -81.39 112.45 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 109.759 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -105.57 170.77 7.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.373 -0.829 . . . . 0.0 110.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.0 OUTLIER -46.53 151.89 0.51 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.56 -0.713 . . . . 0.0 111.04 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 52.2 mm-40 62.86 16.44 9.11 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.714 -0.616 . . . . 0.0 110.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 147.7 47.22 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.907 . . . . 0.0 110.205 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -107.66 109.22 20.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.374 -0.828 . . . . 0.0 109.878 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.3 mt -102.23 158.85 15.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.322 -0.862 . . . . 0.0 110.019 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -108.77 131.98 54.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.86 . . . . 0.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 31.0 tp -107.19 136.08 47.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.35 -0.844 . . . . 0.0 110.009 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t -124.7 149.63 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.271 -0.893 . . . . 0.0 110.222 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mt -94.6 122.46 37.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.413 -0.804 . . . . 0.0 110.143 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -86.28 66.64 9.63 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.32 -0.863 . . . . 0.0 110.109 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -62.4 172.1 1.66 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.368 -0.833 . . . . 0.0 110.268 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.64 126.41 30.95 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.456 -0.778 . . . . 0.0 110.124 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.75 34.28 1.89 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 CA-C-O 117.986 -1.452 . . . . 0.0 109.556 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.7 t0 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.31 0.576 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.18 -27.11 60.66 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.22 -0.925 . . . . 0.0 109.084 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.39 -42.17 99.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.629 -0.829 . . . . 0.0 108.807 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.54 -30.38 70.67 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.44 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -77.1 -35.22 56.56 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.569 -0.707 . . . . 0.0 109.774 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.79 -55.91 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.337 -179.907 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -44.29 67.19 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 110.536 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.2 m -67.06 -44.69 79.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.409 -0.807 . . . . 0.0 110.618 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.8 tp -80.52 -12.08 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.275 -0.891 . . . . 0.0 110.259 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.6 m -76.05 -41.52 50.45 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -82.26 -24.56 34.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.452 -0.78 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.309 -0.869 . . . . 0.0 110.366 -179.98 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.9 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.368 0.604 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.563 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.3 pt-20 -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.538 -0.726 . . . . 0.0 109.268 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.443 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.6 mt-10 -85.43 -40.07 16.84 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.01 -42.73 97.05 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -69.57 -34.9 74.83 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.67 -37.15 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.879 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.79 -34.87 79.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -77.82 -44.59 26.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.565 -0.709 . . . . 0.0 109.926 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.86 -33.38 72.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.369 -0.832 . . . . 0.0 110.065 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.9 tpp -80.58 -21.91 41.21 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.801 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.459 -0.775 . . . . 0.0 110.028 179.847 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.443 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.9 ttp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.131 0.491 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -89.98 139.87 30.19 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.335 -0.853 . . . . 0.0 109.779 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 21.9 pt -137.56 159.64 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.915 . . . . 0.0 110.353 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.92 143.54 42.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.713 -0.617 . . . . 0.0 110.517 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 65.0 t -128.02 121.07 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.321 -0.862 . . . . 0.0 109.854 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 4.0 mtpt -99.98 128.13 46.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.181 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.7 p -95.9 177.27 5.82 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.485 -0.759 . . . . 0.0 110.506 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.489 HD21 HG22 ' B' ' 70' ' ' VAL . 4.6 mm? -61.35 -14.46 27.46 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.557 -0.714 . . . . 0.0 110.956 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.7 p -95.61 17.74 14.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.154 -0.966 . . . . 0.0 110.683 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.12 11.06 58.11 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 6.2 tmtm? -85.0 132.63 34.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.08 -1.247 . . . . 0.0 109.816 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -113.19 125.19 54.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.396 -0.815 . . . . 0.0 110.273 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.7 mt -109.31 135.4 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 110.405 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.3 m -102.32 118.48 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.194 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -123.5 164.22 19.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.229 -0.92 . . . . 0.0 110.916 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -106.38 116.99 32.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.495 -0.753 . . . . 0.0 109.423 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.459 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.7 m -140.17 174.98 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.841 . . . . 0.0 110.746 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -113.1 165.81 12.43 Favored Pre-proline 0 N--CA 1.488 1.444 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.69 -26.13 16.53 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 123.617 1.325 . . . . 0.0 110.398 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.51 -4.0 58.71 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.057 -1.027 . . . . 0.0 110.508 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.22 138.84 49.82 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.54 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 68.0 p -83.37 160.24 21.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.482 -0.761 . . . . 0.0 110.248 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.705 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.22 -28.98 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.93 -40.51 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 109.38 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ASN . . . . . 0.405 ' ND2' ' OG1' ' B' ' 22' ' ' THR . 49.2 m-80 -70.14 -31.36 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.544 -0.722 . . . . 0.0 109.483 179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 81.8 t -70.16 -40.97 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.773 . . . . 0.0 109.27 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -62.99 -42.98 99.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.406 -0.809 . . . . 0.0 109.238 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -34.29 75.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.47 -0.769 . . . . 0.0 109.475 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.459 ' CD ' HG12 ' B' ' 17' ' ' VAL . 21.9 mttp -68.03 -39.97 83.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.524 -0.735 . . . . 0.0 109.674 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.506 HD13 HD22 ' B' ' 69' ' ' LEU . 18.7 mt -67.15 -37.68 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 0.0 109.071 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -52.08 66.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.813 . . . . 0.0 109.68 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -58.13 -27.63 63.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.451 -0.781 . . . . 0.0 110.643 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.03 -38.2 21.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.164 -0.96 . . . . 0.0 110.854 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -108.07 -56.43 2.24 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.226 -0.921 . . . . 0.0 110.502 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.15 17.64 1.98 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.499 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.9 mt -91.44 143.59 28.39 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.076 -1.249 . . . . 0.0 109.785 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -67.66 133.44 29.72 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.65 1.342 . . . . 0.0 110.415 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.69 -26.7 83.47 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.732 1.386 . . . . 0.0 110.849 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -24.89 64.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.84 . . . . 0.0 109.956 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.418 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.1 mt-30 -101.31 3.11 40.4 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.348 -0.845 . . . . 0.0 110.465 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -94.17 137.65 33.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.124 -0.985 . . . . 0.0 110.327 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -130.06 129.52 43.73 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.429 -0.794 . . . . 0.0 109.863 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.793 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.9 mt -104.45 116.89 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.397 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.793 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.37 135.36 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.482 -0.761 . . . . 0.0 109.675 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.483 ' HB2' HD23 ' B' ' 67' ' ' LEU . 44.0 t80 -141.12 154.06 45.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 26.73 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.481 -0.762 . . . . 0.0 111.329 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.99 -3.74 74.54 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.159 -1.02 . . . . 0.0 110.621 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 136.93 49.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.976 -1.308 . . . . 0.0 110.31 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.29 134.92 37.45 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.21 -0.931 . . . . 0.0 109.832 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.665 HD22 ' CG ' ' B' ' 59' ' ' TYR . 26.7 mt -83.96 144.77 28.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' GLU . . . . . 0.403 ' HB2' ' CG ' ' B' ' 54' ' ' ARG . 56.0 mm-40 -93.65 130.59 39.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.378 -0.826 . . . . 0.0 110.433 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.426 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.4 p30 -48.58 -26.83 2.41 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.522 -0.736 . . . . 0.0 111.435 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.64 -5.16 89.72 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.403 ' CG ' ' HB2' ' B' ' 51' ' ' GLU . 13.5 mmt180 -99.6 157.91 16.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.076 -1.249 . . . . 0.0 110.45 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 65.2 p -102.63 161.5 13.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.82 . . . . 0.0 110.212 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.546 HD22 HG21 ' B' ' 61' ' ' ILE . 68.7 mt -53.63 -47.34 70.36 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.389 -0.819 . . . . 0.0 110.626 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.8 t -56.74 -37.0 70.4 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.432 -0.793 . . . . 0.0 111.17 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.33 -26.62 65.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.147 -0.971 . . . . 0.0 110.24 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.665 ' CG ' HD22 ' B' ' 50' ' ' LEU . 25.3 m-85 -101.04 27.16 6.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.379 -0.826 . . . . 0.0 109.829 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.64 28.01 3.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.444 -0.785 . . . . 0.0 110.688 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.546 HG21 HD22 ' B' ' 56' ' ' LEU . 88.8 mt -81.56 112.01 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.362 -0.836 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -105.66 171.7 7.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 64' ' ' GLU . 0.9 OUTLIER -46.62 157.18 0.15 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.514 -0.741 . . . . 0.0 111.268 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' B' ' 64' ' ' GLU . 0.0 OUTLIER 63.81 8.36 3.76 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.791 177.322 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -71.54 142.36 50.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.018 -1.051 . . . . 0.0 110.153 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 23.4 m -107.77 113.51 26.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.36 -0.837 . . . . 0.0 109.973 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.483 HD23 ' HB2' ' B' ' 45' ' ' PHE . 1.7 mt -102.18 164.18 11.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.33 -0.856 . . . . 0.0 110.048 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -108.58 128.87 55.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.32 -0.863 . . . . 0.0 109.959 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.506 HD22 HD13 ' B' ' 30' ' ' ILE . 48.0 tp -107.02 132.71 52.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.277 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.489 HG22 HD21 ' B' ' 8' ' ' LEU . 41.5 t . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.375 -0.828 . . . . 0.0 110.181 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.339 0.59 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -75.31 -28.44 59.68 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.234 -0.916 . . . . 0.0 109.191 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.19 82.06 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.692 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -31.58 68.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -74.58 -42.58 58.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.479 -0.763 . . . . 0.0 109.511 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.2 OUTLIER -78.42 -53.06 7.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.471 -0.768 . . . . 0.0 110.321 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 ttp -53.55 -40.99 66.01 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.204 -0.935 . . . . 0.0 110.524 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.2 m -64.78 -47.38 78.34 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.441 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.6 tp -82.45 -11.69 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.9 . . . . 0.0 110.391 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 31.8 t -72.9 -46.85 50.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 109.8 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -81.85 -26.28 34.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.812 . . . . 0.0 109.908 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.318 -0.864 . . . . 0.0 110.245 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.313 0.578 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.549 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 pt-20 -69.39 -31.08 69.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.484 -0.76 . . . . 0.0 109.114 179.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.456 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.6 OUTLIER -85.27 -39.54 17.62 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.856 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -63.92 -46.08 86.39 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -65.63 -34.22 77.73 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.549 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.2 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.863 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.71 90.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.506 -0.746 . . . . 0.0 109.722 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -44.56 93.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.419 -0.801 . . . . 0.0 110.051 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.67 -31.1 61.81 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.863 . . . . 0.0 110.361 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.0 tpt -83.42 -24.97 31.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.367 -0.833 . . . . 0.0 110.023 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.0 110.081 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.342 0.592 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -103.07 147.03 27.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.0 110.109 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.703 HD13 HG21 ' B' ' 17' ' ' VAL . 38.3 pt -137.52 158.28 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -111.99 143.84 42.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.598 -0.689 . . . . 0.0 110.613 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 63.8 t -127.89 120.75 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.46 -0.775 . . . . 0.0 109.491 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.1 mtpt -100.03 129.81 46.12 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.409 -0.807 . . . . 0.0 110.568 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.573 HG22 HD23 ' B' ' 69' ' ' LEU . 32.2 p -95.81 175.98 6.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.401 -0.812 . . . . 0.0 110.283 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.442 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.5 mm? -61.16 -15.97 39.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.794 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.4 p -95.96 20.45 10.03 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.097 -1.002 . . . . 0.0 110.765 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.87 13.78 59.86 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.5 tttp -84.76 130.09 34.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.051 -1.264 . . . . 0.0 109.768 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.1 m -113.05 124.96 53.83 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.143 -0.973 . . . . 0.0 110.439 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 6.5 mt -109.32 133.23 55.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.409 -0.807 . . . . 0.0 110.259 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.7 m -102.38 118.76 37.55 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.371 -0.831 . . . . 0.0 109.564 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 67.9 mt -123.42 168.69 12.22 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.218 -0.926 . . . . 0.0 110.792 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.61 116.03 31.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.399 -0.813 . . . . 0.0 109.642 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.703 HG21 HD13 ' B' ' 3' ' ' ILE . 35.0 m -140.43 169.77 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.696 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.509 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.1 mp0 -112.62 166.07 11.77 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.57 -0.706 . . . . 0.0 109.294 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.16 -25.63 18.82 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 123.538 1.283 . . . . 0.0 110.313 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -84.33 -3.56 58.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.506 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.21 141.41 50.63 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.178 -0.951 . . . . 0.0 110.465 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 46.4 p -83.17 157.13 22.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.54 -0.725 . . . . 0.0 110.367 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.503 HG23 HD12 ' B' ' 43' ' ' LEU . 43.0 mm -59.55 -35.3 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.292 -0.88 . . . . 0.0 109.435 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.16 -37.26 79.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.458 -0.776 . . . . 0.0 109.276 179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.32 -30.15 67.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.553 -0.717 . . . . 0.0 109.296 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 22' ' ' THR . 60.2 t -70.54 -41.44 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.468 -0.77 . . . . 0.0 109.16 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -62.85 -43.82 97.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.403 -0.81 . . . . 0.0 109.151 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -31.71 71.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.73 . . . . 0.0 109.289 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.451 ' HE2' HG12 ' B' ' 17' ' ' VAL . 13.4 mttp -68.35 -40.36 81.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.556 -0.715 . . . . 0.0 109.363 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.8 mt -67.09 -37.56 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.024 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 54.9 tt0 -60.78 -51.76 67.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.376 -0.827 . . . . 0.0 109.631 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.15 -27.1 63.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.433 -0.792 . . . . 0.0 110.592 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.93 -41.72 17.07 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.294 -0.879 . . . . 0.0 110.865 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -108.13 -53.72 2.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.217 -0.927 . . . . 0.0 110.427 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.5 19.74 2.04 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.151 -1.18 . . . . 0.0 110.151 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.489 HG23 ' HD2' ' B' ' 37' ' ' PRO . 51.8 mt -91.39 143.42 28.18 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.108 -1.231 . . . . 0.0 109.823 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -69.69 133.04 24.74 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.663 1.349 . . . . 0.0 110.437 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.84 -25.78 81.86 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 O-C-N 123.705 1.371 . . . . 0.0 110.845 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -68.78 -25.2 64.58 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.304 -0.873 . . . . 0.0 109.88 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 29.5 mm-40 -101.33 5.16 42.19 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.433 -0.792 . . . . 0.0 110.46 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' GLN . . . . . 0.429 ' HG2' HD11 ' B' ' 69' ' ' LEU . 6.9 mt-30 -94.26 141.82 28.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.0 110.425 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.12 124.46 32.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.447 -0.783 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 28.1 mt -104.6 118.19 35.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.217 -0.927 . . . . 0.0 110.274 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.8 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -120.89 133.04 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.571 -0.706 . . . . 0.0 109.714 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.527 ' HB2' HD23 ' B' ' 67' ' ' LEU . 29.1 t80 -140.87 147.21 38.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.429 -0.794 . . . . 0.0 110.064 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.27 28.79 0.47 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.76 . . . . 0.0 111.191 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.49 2.91 85.72 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -111.13 134.79 52.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.045 -1.268 . . . . 0.0 110.243 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -78.46 134.46 37.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 109.406 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.7 HD12 ' HB3' ' B' ' 43' ' ' LEU . 35.0 mt -83.88 137.07 33.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.239 -0.913 . . . . 0.0 110.361 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -93.76 130.64 39.67 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.791 . . . . 0.0 110.41 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.461 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.39 -26.87 2.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.494 -0.754 . . . . 0.0 111.211 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.81 86.69 Favored Glycine 0 N--CA 1.494 2.547 0 C-N-CA 120.046 -1.073 . . . . 0.0 110.608 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -99.42 156.28 17.1 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.045 -1.268 . . . . 0.0 110.483 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.6 p -102.42 163.84 12.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.373 -0.829 . . . . 0.0 110.158 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.509 HD12 ' O ' ' B' ' 18' ' ' GLU . 85.6 mt -53.5 -44.47 69.11 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.313 -0.867 . . . . 0.0 110.465 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 27.4 p -56.86 -36.31 69.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.398 -0.814 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.59 -27.96 66.73 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.099 -1.001 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.553 ' CD2' HD22 ' B' ' 50' ' ' LEU . 50.4 m-85 -101.13 27.54 6.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 109.93 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 50.6 28.2 3.34 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.604 -0.685 . . . . 0.0 110.683 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.485 HD12 ' HA ' ' B' ' 56' ' ' LEU . 90.9 mt -81.54 108.87 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.93 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.58 174.68 5.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.344 -0.847 . . . . 0.0 110.065 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.56 153.37 0.38 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.465 -0.772 . . . . 0.0 111.022 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 7.6 mt-10 62.64 16.32 8.77 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.667 -0.645 . . . . 0.0 110.681 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.55 142.05 50.08 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 20.3 m -107.64 109.93 21.67 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.334 -0.854 . . . . 0.0 110.115 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.527 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.2 mt -102.54 160.72 14.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.84 . . . . 0.0 110.101 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -108.83 132.66 53.79 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.306 -0.871 . . . . 0.0 110.043 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.573 HD23 HG22 ' B' ' 7' ' ' THR . 54.7 tp -107.28 129.38 54.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.305 -0.872 . . . . 0.0 110.184 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.46 -0.775 . . . . 0.0 110.071 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t70 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.219 0.533 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -77.67 -28.67 51.2 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.183 -0.948 . . . . 0.0 109.517 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.26 79.89 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.414 -0.915 . . . . 0.0 108.786 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 70' ' ' THR . 14.1 tp -73.04 -30.94 64.11 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -77.55 -34.35 53.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.595 -0.69 . . . . 0.0 109.669 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.47 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -84.63 -51.29 6.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 109.926 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.33 -38.62 63.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.275 -0.891 . . . . 0.0 110.425 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 66' ' ' LEU . 14.4 t -74.59 -36.27 63.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.243 -0.911 . . . . 0.0 110.474 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.47 HG22 ' HA ' ' A' ' 68' ' ' LYS . 3.4 tp -85.45 -14.01 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.387 -0.821 . . . . 0.0 110.323 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' LYS . 35.5 t -83.82 -33.41 24.93 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.926 . . . . 0.0 109.992 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.86 -24.31 19.38 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.299 -0.876 . . . . 0.0 110.185 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.32 -0.863 . . . . 0.0 110.232 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.489 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 77.4 p . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.421 0.629 . . . . 0.0 110.426 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.58 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 2.8 mt-10 -73.53 -29.85 62.72 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.559 -0.713 . . . . 0.0 109.077 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.44 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 31.7 mt-10 -85.09 -36.97 20.81 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.489 ' HB2' ' N ' ' A' ' 88' ' ' THR . 7.8 mm-40 -66.19 -45.27 81.42 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -66.47 -34.79 78.73 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.58 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -65.61 -36.24 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 178.84 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.41 71.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.494 -0.754 . . . . 0.0 109.613 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -84.52 -46.13 11.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.462 -0.774 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.44 -30.92 67.89 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.417 -0.802 . . . . 0.0 110.505 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.4 ttm -82.3 -25.52 33.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.285 -0.884 . . . . 0.0 109.971 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 110.147 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.137 0.494 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.24 140.71 29.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.797 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.8 pt -137.38 159.79 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.906 . . . . 0.0 110.291 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.98 143.62 42.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.576 -0.703 . . . . 0.0 110.686 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 82.4 t -127.72 116.87 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.447 -0.783 . . . . 0.0 109.352 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.616 ' HG3' HG23 ' B' ' 12' ' ' THR . 13.4 mttt -100.18 131.87 45.87 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.345 -0.847 . . . . 0.0 110.813 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.433 HG22 HD23 ' B' ' 69' ' ' LEU . 17.5 p -95.99 173.34 7.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.878 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.402 HD11 HG13 ' B' ' 70' ' ' VAL . 8.6 mt -61.66 -12.01 14.31 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.343 -0.848 . . . . 0.0 110.941 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 63.8 p -95.65 16.06 18.31 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.036 -1.04 . . . . 0.0 110.767 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.36 8.59 66.46 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 120.195 -1.003 . . . . 0.0 110.629 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 11.6 tttt -84.75 127.27 34.03 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.052 -1.264 . . . . 0.0 109.905 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.616 HG23 ' HG3' ' B' ' 6' ' ' LYS . 3.5 m -113.24 126.84 55.85 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.977 . . . . 0.0 110.495 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 13.1 mt -109.46 136.67 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.358 -0.839 . . . . 0.0 110.439 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m -102.3 120.52 40.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.1 mt -123.49 162.22 23.31 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.117 -0.99 . . . . 0.0 110.857 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -106.55 116.15 31.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.475 -0.765 . . . . 0.0 109.664 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.24 176.45 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 110.787 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.408 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -113.14 163.24 18.62 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.689 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.44 -26.69 20.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.513 1.27 . . . . 0.0 110.276 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 m -84.54 -2.48 57.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.261 -0.9 . . . . 0.0 110.614 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -71.36 145.15 49.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.541 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.33 156.33 23.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.661 -0.65 . . . . 0.0 110.432 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.451 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.7 mm -59.61 -32.75 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 109.431 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -62.58 -36.74 83.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -70.21 -31.51 68.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.514 -0.742 . . . . 0.0 109.124 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.99 -40.37 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttt -62.92 -40.6 98.12 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -34.75 76.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 109.348 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.9 -39.99 83.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.571 -0.706 . . . . 0.0 109.554 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.0 mt -67.31 -37.62 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.152 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.4 tm0? -60.87 -53.33 58.62 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.469 -0.769 . . . . 0.0 109.833 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.1 -27.73 63.98 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.386 -0.821 . . . . 0.0 110.746 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -84.12 -36.52 22.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 111.167 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -108.07 -53.14 2.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.202 -0.936 . . . . 0.0 110.602 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.61 14.15 3.6 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.471 HG23 ' HD2' ' B' ' 37' ' ' PRO . 69.2 mt -91.37 143.25 27.94 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.107 -1.231 . . . . 0.0 109.874 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.544 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 38.7 Cg_endo -67.4 135.39 36.43 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.61 1.321 . . . . 0.0 110.391 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 -24.74 79.32 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.727 1.383 . . . . 0.0 111.001 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.73 -25.38 64.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.317 -0.865 . . . . 0.0 109.804 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.544 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.58 6.87 44.27 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.533 -0.73 . . . . 0.0 110.541 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -94.3 139.52 30.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.445 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.1 122.82 29.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.452 -0.78 . . . . 0.0 109.845 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.793 ' HB3' HD12 ' B' ' 50' ' ' LEU . 28.0 mt -104.7 116.69 32.47 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.481 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.786 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.12 133.78 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.553 -0.717 . . . . 0.0 109.658 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -140.39 151.64 45.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.458 -0.776 . . . . 0.0 109.807 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.38 28.14 0.44 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.472 -0.768 . . . . 0.0 111.048 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.52 2.31 79.72 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -111.13 138.3 47.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.246 . . . . 0.0 110.292 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -78.39 135.88 37.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.9 . . . . 0.0 109.459 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.793 HD12 ' HB3' ' B' ' 43' ' ' LEU . 39.8 mt -83.79 138.45 33.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 110.315 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -93.67 127.76 39.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.387 -0.821 . . . . 0.0 110.6 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.33 -26.42 2.02 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 111.135 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -10.45 82.95 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.733 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.25 158.3 15.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.31 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 41.3 p -102.39 166.15 10.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.768 . . . . 0.0 110.373 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.504 ' HA ' HD12 ' B' ' 61' ' ' ILE . 55.4 mt -53.64 -44.21 69.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.317 -0.864 . . . . 0.0 110.751 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 94.0 p -56.83 -36.77 70.36 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.342 -0.849 . . . . 0.0 111.153 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.55 -27.06 65.89 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.135 -0.978 . . . . 0.0 110.532 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.582 ' CD2' HD22 ' B' ' 50' ' ' LEU . 55.2 m-85 -101.06 24.72 8.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.883 . . . . 0.0 110.221 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 50.69 30.33 4.86 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.4 -0.813 . . . . 0.0 110.723 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.528 HD13 HD21 ' B' ' 67' ' ' LEU . 73.5 mt -81.67 113.45 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.29 -0.881 . . . . 0.0 110.015 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.78 170.47 7.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.9 . . . . 0.0 110.262 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.74 153.28 0.41 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.568 -0.707 . . . . 0.0 111.103 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.84 16.1 8.8 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.611 -0.68 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.56 144.59 49.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.153 -0.967 . . . . 0.0 110.082 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.7 m -107.53 110.49 22.43 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.528 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.42 162.62 12.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.368 -0.832 . . . . 0.0 110.213 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -109.03 130.58 55.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.363 -0.835 . . . . 0.0 109.941 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.433 HD23 HG22 ' B' ' 7' ' ' THR . 55.0 tp -106.97 127.75 53.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.402 HG13 HD11 ' B' ' 8' ' ' LEU . 48.6 t . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.303 -0.873 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.218 0.532 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -75.9 -29.78 58.58 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.239 -0.913 . . . . 0.0 109.163 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.84 -36.29 82.73 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.434 -0.906 . . . . 0.0 108.69 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -29.09 64.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.489 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.5 tt -78.73 -37.68 40.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.51 -0.744 . . . . 0.0 109.803 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.436 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.04 -50.71 7.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.5 -0.75 . . . . 0.0 110.38 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.3 tpp -57.64 -42.97 84.52 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.264 -0.898 . . . . 0.0 110.438 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.8 m -68.35 -41.73 80.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.337 -0.852 . . . . 0.0 110.571 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.436 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.3 tp -82.95 -14.98 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.253 -0.904 . . . . 0.0 110.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' LYS . 8.2 t -74.15 -45.33 49.43 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.889 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -79.59 -26.42 41.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.44 -0.788 . . . . 0.0 109.956 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.347 -0.846 . . . . 0.0 110.153 179.907 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.365 0.602 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.1 mt-10 -71.92 -30.32 65.23 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.462 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mm-40 -83.85 -38.07 21.66 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -45.24 85.3 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.07 -34.2 77.52 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.557 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -67.37 -33.67 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.906 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.74 -28.9 69.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.398 -0.814 . . . . 0.0 109.8 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.78 -39.31 20.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.411 -0.806 . . . . 0.0 110.355 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.95 -29.3 32.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.282 -0.886 . . . . 0.0 110.724 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 tpt -82.27 -27.47 32.38 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 . . . . . 0 N--CA 1.488 1.433 0 O-C-N 121.478 -0.764 . . . . 0.0 109.764 179.695 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.479 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.0 ttp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.213 0.53 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -88.21 138.69 31.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 109.855 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.6 pt -137.42 158.82 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.343 -0.848 . . . . 0.0 110.365 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -111.84 142.55 44.07 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.616 -0.677 . . . . 0.0 110.628 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t -127.97 119.59 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.383 -0.823 . . . . 0.0 109.507 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.453 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.7 mtpm? -100.32 131.15 46.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.803 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.2 p -96.21 176.86 5.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 110.18 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.62 -15.08 36.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.449 -0.782 . . . . 0.0 110.954 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 78.0 p -95.8 19.88 10.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.041 -1.037 . . . . 0.0 110.767 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.91 12.83 58.26 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.06 34.86 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.242 . . . . 0.0 109.729 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 25.1 m -112.88 126.75 55.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.273 -0.892 . . . . 0.0 110.42 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.3 mt -109.31 138.54 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.39 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.3 m -101.93 119.71 39.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.0 109.13 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.405 HD23 ' HE3' ' B' ' 33' ' ' LYS . 30.0 mt -123.47 160.68 26.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.055 -178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 114.91 29.32 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.527 -0.733 . . . . 0.0 109.409 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.479 ' O ' ' HB3' ' B' ' 1' ' ' MET . 28.4 m -140.16 176.99 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 110.882 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.483 ' O ' HD12 ' B' ' 56' ' ' LEU . 5.5 mt-10 -113.29 164.21 16.26 Favored Pre-proline 0 N--CA 1.49 1.536 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.9 -26.07 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 123.543 1.286 . . . . 0.0 110.346 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 -3.13 58.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.212 -0.93 . . . . 0.0 110.739 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.27 144.1 50.14 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.139 -0.976 . . . . 0.0 110.617 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 67.5 p -83.15 158.48 22.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.535 -0.728 . . . . 0.0 110.206 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.854 HG23 HD12 ' B' ' 43' ' ' LEU . 43.7 mm -59.58 -36.97 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 109.542 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.74 -35.46 76.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.453 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -70.44 -32.99 70.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.468 -0.77 . . . . 0.0 109.351 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.94 -39.8 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.0 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.412 ' HE2' HG22 ' B' ' 23' ' ' ILE . 18.6 mtmt -62.99 -41.19 99.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 109.036 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.42 77.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.573 -0.704 . . . . 0.0 109.391 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -37.5 81.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.437 -0.789 . . . . 0.0 109.388 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.4 mt -67.18 -37.46 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.769 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -60.71 -51.28 70.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.549 -0.719 . . . . 0.0 109.531 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -58.13 -27.25 63.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.55 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.405 ' HE3' HD23 ' B' ' 15' ' ' LEU . 21.3 mmtt -84.07 -39.47 19.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.214 -0.929 . . . . 0.0 110.841 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -108.16 -55.75 2.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.249 -0.907 . . . . 0.0 110.6 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.2 14.24 2.03 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.496 HG23 ' HD2' ' B' ' 37' ' ' PRO . 13.8 mt -91.17 143.81 28.95 Favored Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.115 -1.227 . . . . 0.0 109.573 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.7 Cg_endo -68.38 131.74 23.99 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 O-C-N 123.631 1.332 . . . . 0.0 110.6 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.01 -25.41 81.44 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.719 1.378 . . . . 0.0 110.777 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -68.69 -24.13 64.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 109.768 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -101.19 2.59 40.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.455 -0.778 . . . . 0.0 110.427 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -94.35 141.95 27.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.234 -0.916 . . . . 0.0 110.473 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.36 131.77 45.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.529 -0.732 . . . . 0.0 109.801 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.854 HD12 HG23 ' B' ' 23' ' ' ILE . 18.2 mt -104.62 120.86 42.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.349 -0.844 . . . . 0.0 110.467 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.801 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.08 133.01 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.496 -0.753 . . . . 0.0 109.65 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.532 ' HB2' HD23 ' B' ' 67' ' ' LEU . 40.1 t80 -140.65 150.66 43.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.416 -0.803 . . . . 0.0 110.16 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.68 0.46 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.457 -0.777 . . . . 0.0 111.217 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.48 80.27 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -110.97 137.46 48.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.968 -1.313 . . . . 0.0 110.239 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.49 134.35 37.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.397 -0.814 . . . . 0.0 109.688 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.809 HD12 ' HB3' ' B' ' 43' ' ' LEU . 31.9 mt -83.8 141.04 31.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.232 -0.917 . . . . 0.0 110.306 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -93.49 129.32 39.73 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.358 -0.839 . . . . 0.0 110.524 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 73.1 m-20 -48.29 -26.11 1.86 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.734 . . . . 0.0 111.229 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.78 -9.31 84.72 Favored Glycine 0 N--CA 1.493 2.482 0 C-N-CA 120.139 -1.029 . . . . 0.0 110.553 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -99.35 156.8 16.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.994 -1.297 . . . . 0.0 110.483 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 31.8 p -102.38 167.65 9.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 110.181 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.604 ' HA ' HD12 ' B' ' 61' ' ' ILE . 86.6 mt -53.69 -47.02 70.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.255 -0.903 . . . . 0.0 110.629 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.76 -34.71 67.85 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.368 -0.833 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.63 -29.46 68.03 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.152 -0.967 . . . . 0.0 110.384 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.636 ' CG ' HD22 ' B' ' 50' ' ' LEU . 47.3 m-85 -101.24 28.97 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.835 . . . . 0.0 109.867 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.69 28.43 3.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.593 -0.692 . . . . 0.0 110.785 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.604 HD12 ' HA ' ' B' ' 56' ' ' LEU . 97.4 mt -81.36 108.54 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 109.741 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -105.73 173.53 6.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.379 -0.826 . . . . 0.0 110.366 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.4 OUTLIER -46.55 152.36 0.47 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.526 -0.734 . . . . 0.0 110.933 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.6 mm-40 62.97 15.87 8.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.701 -0.624 . . . . 0.0 110.59 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 144.93 49.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 0.0 110.079 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -107.56 106.83 17.38 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.33 -0.856 . . . . 0.0 109.929 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.532 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.4 mt -102.57 160.49 14.52 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -108.88 135.91 49.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -0.885 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.2 tp -107.13 131.65 53.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.291 -0.881 . . . . 0.0 110.411 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 19.4 t . . . . . 0 N--CA 1.493 1.691 0 O-C-N 121.395 -0.816 . . . . 0.0 110.121 179.894 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.293 0.568 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.38 -32.48 58.59 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.205 -0.934 . . . . 0.0 109.21 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.69 80.86 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 108.901 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mp -70.16 -30.68 67.88 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.648 ' O ' HD13 ' A' ' 67' ' ' LEU . 3.1 tm? -73.87 -42.95 60.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.453 -0.779 . . . . 0.0 109.46 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -80.41 -53.25 6.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.424 -0.797 . . . . 0.0 110.599 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -53.77 -38.51 64.51 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.109 -0.995 . . . . 0.0 110.623 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 47.3 m -70.31 -41.36 73.4 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.264 -0.898 . . . . 0.0 110.494 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.446 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.8 tp -84.34 -14.55 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.173 -0.954 . . . . 0.0 110.368 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -75.66 -44.67 41.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.284 -0.885 . . . . 0.0 109.658 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -79.06 -27.04 43.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.483 -0.761 . . . . 0.0 109.967 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 . . . . . 0 N--CA 1.493 1.677 0 O-C-N 121.359 -0.838 . . . . 0.0 110.229 179.937 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.35 0.595 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.58 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.5 pt-20 -66.07 -33.55 76.04 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.445 -0.784 . . . . 0.0 109.456 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.431 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 29.2 mt-10 -85.2 -39.73 17.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.662 -0.649 . . . . 0.0 109.543 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.12 -41.67 90.21 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -69.98 -34.63 73.61 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.58 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -58.76 -34.97 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.71 61.88 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.57 -0.706 . . . . 0.0 109.519 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.71 -34.12 77.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.519 -0.738 . . . . 0.0 109.943 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.77 -37.2 41.64 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.411 -0.805 . . . . 0.0 110.071 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.7 tpp -81.15 -25.95 36.46 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.286 -0.884 . . . . 0.0 109.79 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.414 -0.804 . . . . 0.0 109.82 179.88 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.458 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 39.3 ttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.339 0.59 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -120.44 139.17 53.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.486 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.529 HD13 HG21 ' B' ' 17' ' ' VAL . 45.0 pt -137.55 158.33 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.223 -0.923 . . . . 0.0 110.514 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -111.78 145.56 39.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.608 -0.683 . . . . 0.0 110.297 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' B' ' 12' ' ' THR . 60.7 t -128.18 122.63 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.373 -0.829 . . . . 0.0 109.844 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.434 ' HG3' HG23 ' B' ' 12' ' ' THR . 0.1 OUTLIER -100.13 135.9 40.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.358 -0.839 . . . . 0.0 110.182 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.2 p -95.67 171.52 8.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.39 -0.819 . . . . 0.0 110.583 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.477 HD21 HG22 ' B' ' 70' ' ' VAL . 4.5 mm? -61.26 -13.28 17.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.506 -0.746 . . . . 0.0 111.192 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 75.8 p -95.44 -21.06 18.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.119 -0.988 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.89 9.2 14.16 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.941 -1.123 . . . . 0.0 110.394 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 131.76 34.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.071 -1.252 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.434 HG23 ' HG3' ' B' ' 6' ' ' LYS . 1.8 m -113.02 122.24 47.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.121 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mt -109.11 137.0 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.401 -0.812 . . . . 0.0 110.335 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.1 m -102.11 122.14 43.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.516 HD11 HG12 ' B' ' 30' ' ' ILE . 82.5 mt -123.44 161.45 24.78 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.171 -0.955 . . . . 0.0 110.806 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -106.25 116.12 31.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.534 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.529 HG21 HD13 ' B' ' 3' ' ' ILE . 34.9 m -140.03 179.12 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.336 -0.853 . . . . 0.0 110.627 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.569 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.4 mp0 -113.12 165.18 13.75 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.495 -0.753 . . . . 0.0 109.29 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.51 -27.59 15.49 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.593 1.312 . . . . 0.0 110.338 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.44 -2.34 57.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.214 -0.928 . . . . 0.0 110.494 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -71.21 143.27 50.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.23 -0.919 . . . . 0.0 110.44 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 82.5 p -83.22 160.33 21.8 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.513 -0.742 . . . . 0.0 110.261 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.435 HG13 ' HB3' ' B' ' 50' ' ' LEU . 48.4 mm -59.83 -38.16 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.41 -33.43 72.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 109.365 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -70.32 -35.27 73.54 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.537 -0.727 . . . . 0.0 109.217 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.65 -37.17 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.458 -0.776 . . . . 0.0 108.926 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -63.08 -42.16 99.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.445 -0.784 . . . . 0.0 108.922 178.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.19 75.1 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.606 -0.684 . . . . 0.0 109.325 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.496 ' HE3' HG12 ' B' ' 17' ' ' VAL . 14.4 mttt -68.35 -38.55 81.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.464 -0.773 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.516 HG12 HD11 ' B' ' 15' ' ' LEU . 10.9 mt -67.26 -40.93 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 109.223 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -48.68 80.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.421 -0.8 . . . . 0.0 109.497 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.89 -28.03 63.84 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.505 -0.747 . . . . 0.0 110.206 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -83.53 -42.66 16.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 110.146 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -108.33 -118.18 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.444 -0.785 . . . . 0.0 109.743 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.8 23.93 0.22 Allowed Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.783 -1.199 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.458 HG23 ' HD2' ' B' ' 37' ' ' PRO . 81.7 mt -91.88 142.2 26.26 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.205 -1.173 . . . . 0.0 110.21 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -69.48 134.15 27.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.698 1.367 . . . . 0.0 110.269 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.74 -26.32 82.77 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.717 1.377 . . . . 0.0 110.84 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.79 -24.98 64.48 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.305 -0.872 . . . . 0.0 109.941 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 30.9 mt-30 -101.27 7.38 42.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 110.514 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -94.38 138.05 32.8 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.483 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.415 ' C ' HD22 ' B' ' 43' ' ' LEU . 2.7 ttm180 -130.32 127.81 40.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.449 -0.782 . . . . 0.0 109.627 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD12 ' B' ' 50' ' ' LEU . 4.4 mm? -104.49 125.01 50.28 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.35 -0.844 . . . . 0.0 110.609 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 1.6 mt -122.25 141.11 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.566 -0.709 . . . . 0.0 110.31 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.664 ' HB3' HD21 ' B' ' 50' ' ' LEU . 47.1 t80 -141.65 148.2 38.76 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.25 0.3 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.511 -0.743 . . . . 0.0 111.482 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.21 1.99 90.27 Favored Glycine 0 N--CA 1.495 2.617 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.743 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -110.8 141.89 43.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.924 -1.339 . . . . 0.0 110.296 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -78.35 132.54 37.45 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 109.784 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.664 HD21 ' HB3' ' B' ' 45' ' ' PHE . 17.9 mt -84.05 142.79 30.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.232 -0.917 . . . . 0.0 110.08 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -93.45 132.75 37.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.358 -0.839 . . . . 0.0 110.406 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.41 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.42 -30.45 5.08 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.55 -0.719 . . . . 0.0 111.019 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.81 -2.66 90.67 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.54 153.73 18.81 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.101 -1.235 . . . . 0.0 110.343 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.8 p -102.19 164.18 11.83 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.85 . . . . 0.0 110.103 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.628 ' HA ' HD12 ' B' ' 61' ' ' ILE . 83.7 mt -53.58 -47.3 70.25 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.297 -0.877 . . . . 0.0 110.683 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 17.8 p -56.8 -36.04 69.45 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.396 -0.815 . . . . 0.0 111.214 -179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.44 -28.91 67.4 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.124 -0.985 . . . . 0.0 110.403 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.651 ' CD2' HD22 ' B' ' 50' ' ' LEU . 35.9 m-85 -101.19 28.32 5.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.419 -0.8 . . . . 0.0 109.908 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 50.77 28.45 3.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.596 -0.69 . . . . 0.0 110.669 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' B' ' 56' ' ' LEU . 92.4 mt -81.4 108.88 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.253 -0.904 . . . . 0.0 109.764 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -105.45 173.28 6.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.388 -0.82 . . . . 0.0 110.348 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.3 ptmt -46.76 152.77 0.45 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.504 -0.748 . . . . 0.0 111.085 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 63.17 14.98 8.17 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.805 -0.559 . . . . 0.0 111.012 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -71.5 145.25 49.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.012 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' THR . . . . . 0.402 ' C ' HD22 ' B' ' 67' ' ' LEU . 86.5 m -107.6 109.8 21.53 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.416 -0.803 . . . . 0.0 109.987 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.693 ' N ' HD22 ' B' ' 67' ' ' LEU . 2.9 mm? -102.47 160.53 14.47 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.309 -0.87 . . . . 0.0 110.134 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.404 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 3.3 m80 -108.64 134.62 51.13 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.3 -0.875 . . . . 0.0 109.688 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.41 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 35.8 tp -107.15 127.57 53.62 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 110.129 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.477 HG22 HD21 ' B' ' 8' ' ' LEU . 44.2 t . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.435 -0.791 . . . . 0.0 110.02 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.139 0.495 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -78.52 -32.28 47.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.212 -0.93 . . . . 0.0 109.131 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.79 -44.67 96.51 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.823 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.43 -29.56 70.61 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.45 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.2 tt -75.49 -37.92 59.85 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.518 -0.739 . . . . 0.0 109.785 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -82.81 -55.43 4.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 110.476 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 ttt -52.87 -41.61 64.47 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 110.687 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 83.7 m -69.01 -40.85 78.43 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.315 -0.866 . . . . 0.0 110.508 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 68' ' ' LYS . 4.1 tp -80.07 -18.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.959 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.93 -38.24 69.89 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.324 -0.86 . . . . 0.0 109.535 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -79.21 -31.78 43.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.461 -0.775 . . . . 0.0 109.673 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.451 -0.781 . . . . 0.0 109.865 179.583 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.2 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.401 0.62 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.53 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 9.6 pt-20 -67.71 -32.23 72.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.468 -0.77 . . . . 0.0 109.258 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 32.7 mt-10 -85.35 -39.74 17.3 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.04 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.81 -44.78 92.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.13 -35.7 81.19 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.37 -33.79 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 178.856 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.76 -48.64 78.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 109.875 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -38.52 65.62 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.42 -0.8 . . . . 0.0 109.698 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.2 -37.89 86.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.446 -0.784 . . . . 0.0 109.992 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.5 ttm -80.66 -26.96 37.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.357 -0.839 . . . . 0.0 109.704 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 O-C-N 121.498 -0.751 . . . . 0.0 109.877 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.6 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.164 0.507 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -90.51 139.45 30.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.439 -0.788 . . . . 0.0 109.843 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -137.25 158.43 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.264 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.77 145.11 39.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.646 . . . . 0.0 110.671 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.7 t -128.03 119.44 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 109.53 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.0 mtmp? -100.26 129.85 46.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.361 -0.837 . . . . 0.0 110.686 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.2 p -96.4 174.81 6.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.437 -0.79 . . . . 0.0 110.067 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mt -61.62 -13.56 23.21 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.312 -0.868 . . . . 0.0 110.841 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 79.0 p -95.57 19.02 11.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.106 -0.997 . . . . 0.0 110.565 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.88 11.57 58.24 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.2 OUTLIER -84.84 128.28 34.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.068 -1.254 . . . . 0.0 109.952 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.4 m -113.09 124.43 52.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.883 . . . . 0.0 110.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mt -109.14 136.88 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.48 -0.762 . . . . 0.0 110.288 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 12.0 m -102.29 120.78 41.06 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.529 -0.732 . . . . 0.0 109.502 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 69.8 mt -123.38 162.93 21.8 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 110.963 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.3 115.71 30.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.537 -0.727 . . . . 0.0 109.347 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.25 174.85 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.285 -0.885 . . . . 0.0 110.863 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.453 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.5 mm-40 -113.14 165.5 13.08 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.41 -24.98 22.01 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 123.507 1.267 . . . . 0.0 110.385 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.0 p -84.6 -4.62 59.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 110.474 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -71.26 139.11 49.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.175 -0.953 . . . . 0.0 110.683 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 57.6 p -83.67 160.21 21.38 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.51 -0.744 . . . . 0.0 110.495 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.892 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.48 -34.88 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.346 -0.846 . . . . 0.0 109.705 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.31 -37.26 80.02 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.371 -0.83 . . . . 0.0 109.386 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -31.48 68.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.463 -0.773 . . . . 0.0 109.203 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 26' ' ' VAL . . . . . 0.408 HG23 ' O ' ' B' ' 22' ' ' THR . 58.1 t -69.92 -41.64 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.515 -0.741 . . . . 0.0 109.078 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.62 ' HD2' HG22 ' B' ' 23' ' ' ILE . 4.4 mttp -62.88 -38.95 92.94 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.437 -0.789 . . . . 0.0 108.947 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.79 -36.18 80.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.488 -0.757 . . . . 0.0 109.346 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.42 ' HD3' HG12 ' B' ' 17' ' ' VAL . 7.0 mttm -68.28 -39.7 82.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.603 HD13 HD22 ' B' ' 69' ' ' LEU . 12.5 mt -66.92 -38.87 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.211 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.67 -50.63 72.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.476 -0.765 . . . . 0.0 109.578 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.87 -26.42 62.09 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.401 -0.812 . . . . 0.0 110.236 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -84.27 -40.46 17.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.807 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.99 -55.54 2.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.441 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.19 17.76 1.96 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.522 HG23 ' HD2' ' B' ' 37' ' ' PRO . 81.1 mt -91.45 144.52 29.78 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.157 -1.202 . . . . 0.0 109.791 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.522 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.9 Cg_endo -70.13 133.48 24.99 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.552 1.291 . . . . 0.0 110.417 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.97 -27.48 84.85 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.736 1.387 . . . . 0.0 111.046 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.83 -22.39 64.24 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.396 -0.815 . . . . 0.0 110.336 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 41.9 mm-40 -101.29 -2.29 31.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.313 -0.867 . . . . 0.0 110.646 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -94.35 143.42 26.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.215 -0.928 . . . . 0.0 110.397 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -130.09 132.19 46.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.942 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.892 HD12 HG23 ' B' ' 23' ' ' ILE . 20.1 mt -104.74 119.54 39.25 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.355 -0.84 . . . . 0.0 110.369 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.792 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.17 134.71 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.503 -0.748 . . . . 0.0 109.907 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.51 ' HB2' HD23 ' B' ' 67' ' ' LEU . 37.2 t80 -141.49 154.53 45.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.548 -0.72 . . . . 0.0 110.007 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.431 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.1 25.56 0.18 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.539 -0.725 . . . . 0.0 111.513 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.34 -4.93 75.14 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.777 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.77 142.84 42.21 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.04 -1.271 . . . . 0.0 110.47 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.71 138.4 38.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.351 -0.843 . . . . 0.0 109.779 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.744 HD12 ' HB3' ' B' ' 43' ' ' LEU . 40.7 mt -84.3 148.4 26.69 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.304 -0.872 . . . . 0.0 109.998 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -93.51 125.95 38.4 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.327 -0.858 . . . . 0.0 110.394 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -48.54 -32.49 8.08 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.362 -0.836 . . . . 0.0 110.984 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.69 -1.85 90.58 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 31.9 mmt-85 -99.57 157.88 16.14 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.066 -1.255 . . . . 0.0 110.29 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.5 p -102.55 162.22 13.09 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.591 ' HA ' HD12 ' B' ' 61' ' ' ILE . 93.7 mt -53.37 -45.38 69.17 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.279 -0.888 . . . . 0.0 110.649 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.87 -36.7 70.38 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.085 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.63 -27.69 66.56 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.187 -0.946 . . . . 0.0 110.361 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.48 ' CD2' HD22 ' B' ' 50' ' ' LEU . 36.9 m-85 -101.09 27.59 5.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.348 -0.845 . . . . 0.0 109.931 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 50.88 28.03 3.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.464 -0.773 . . . . 0.0 110.716 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' B' ' 56' ' ' LEU . 85.9 mt -81.43 112.04 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.349 -0.845 . . . . 0.0 109.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.63 173.02 6.49 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.38 -0.825 . . . . 0.0 110.448 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.8 pttm -46.65 154.16 0.33 Allowed 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.492 0.663 . . . . 0.0 111.177 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.4 mt-10 62.58 15.61 8.09 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.749 -0.594 . . . . 0.0 110.805 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 141.57 49.9 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.179 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.8 m -107.61 110.63 22.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.292 -0.88 . . . . 0.0 109.945 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.51 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.2 mt -102.76 161.47 13.71 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.313 -0.867 . . . . 0.0 110.008 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -108.8 131.64 54.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.306 -0.871 . . . . 0.0 109.951 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.603 HD22 HD13 ' B' ' 30' ' ' ILE . 61.9 tp -106.98 133.85 51.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.217 -0.927 . . . . 0.0 110.551 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 45.1 t . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.35 -0.844 . . . . 0.0 110.205 179.854 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.215 0.531 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -74.77 -27.5 60.36 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.215 -0.928 . . . . 0.0 109.175 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -43.84 97.88 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.874 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.95 -29.15 69.5 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -77.42 -36.84 52.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.529 -0.732 . . . . 0.0 109.866 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.3 -54.77 4.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.399 -0.813 . . . . 0.0 110.499 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.7 mmt -54.44 -43.05 71.25 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.148 -0.97 . . . . 0.0 110.627 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.5 m -69.62 -40.4 76.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.272 -0.892 . . . . 0.0 110.621 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.409 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.0 tp -82.17 -15.96 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.154 -0.966 . . . . 0.0 110.221 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 68' ' ' LYS . 27.5 t -74.77 -42.89 57.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.876 . . . . 0.0 109.791 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -79.25 -27.02 42.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.528 -0.733 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.389 -0.819 . . . . 0.0 110.017 179.899 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.36 0.6 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.3 pt-20 -68.52 -31.68 71.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.521 -0.737 . . . . 0.0 109.196 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.4 mt-10 -85.57 -40.04 16.72 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.25 -44.73 94.32 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -67.35 -34.18 76.78 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -66.38 -34.86 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.938 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.73 -46.0 90.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.514 -0.741 . . . . 0.0 110.238 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -40.19 29.87 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.367 -0.833 . . . . 0.0 109.949 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.91 79.21 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.349 -0.844 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 tpp -83.88 -24.39 30.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.361 -0.837 . . . . 0.0 110.097 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.298 -0.876 . . . . 0.0 110.228 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.333 0.587 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -98.2 147.6 24.44 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.136 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.691 HD13 HG21 ' B' ' 17' ' ' VAL . 34.7 pt -137.63 157.72 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.334 -0.854 . . . . 0.0 110.076 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.41 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 80.5 m-85 -111.94 143.08 43.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.588 -0.695 . . . . 0.0 110.663 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' B' ' 12' ' ' THR . 95.7 t -127.83 119.74 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.49 -0.756 . . . . 0.0 109.455 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 18.7 mttt -100.08 136.75 39.5 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.409 -0.807 . . . . 0.0 110.743 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 73.4 p -96.17 171.13 8.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.437 -0.789 . . . . 0.0 110.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.82 -10.49 9.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.397 -0.814 . . . . 0.0 111.24 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.5 p -95.55 -18.49 20.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.933 -1.105 . . . . 0.0 110.631 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.99 7.4 25.23 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 9.5 tttt -84.61 129.87 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.083 -1.245 . . . . 0.0 109.811 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 7.5 m -113.14 126.1 55.07 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.232 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.4 mt -109.23 136.21 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.432 -0.792 . . . . 0.0 110.489 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.41 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 19.2 m -102.41 119.78 39.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.457 -0.777 . . . . 0.0 109.409 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.422 HD11 HG12 ' B' ' 30' ' ' ILE . 80.3 mt -123.51 166.85 14.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -106.52 114.31 28.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.804 . . . . 0.0 109.48 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.691 HG21 HD13 ' B' ' 3' ' ' ILE . 33.8 m -140.52 169.34 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 110.951 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.427 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.0 OUTLIER -112.61 165.12 13.72 Favored Pre-proline 0 N--CA 1.488 1.474 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.768 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -71.67 -24.73 21.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.466 1.245 . . . . 0.0 110.375 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.45 -5.67 59.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 110.531 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -71.24 143.48 50.4 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.265 -0.897 . . . . 0.0 110.721 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.4 p -83.3 159.52 21.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.588 -0.695 . . . . 0.0 110.391 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.585 HG23 HD12 ' B' ' 43' ' ' LEU . 43.5 mm -59.64 -36.33 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 109.647 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.83 -35.91 77.73 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 109.424 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -70.29 -33.15 71.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.538 -0.726 . . . . 0.0 109.393 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.1 t -70.15 -39.74 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.172 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -62.86 -43.49 98.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.475 -0.766 . . . . 0.0 109.166 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.35 -32.98 72.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.509 -0.744 . . . . 0.0 109.309 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.549 ' CD ' HG12 ' B' ' 17' ' ' VAL . 34.9 mttm -68.28 -39.36 82.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.479 -0.763 . . . . 0.0 109.473 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.422 HG12 HD11 ' B' ' 15' ' ' LEU . 10.2 mt -67.26 -38.69 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.369 -0.832 . . . . 0.0 109.09 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.5 OUTLIER -60.53 -50.67 72.64 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.491 179.108 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.19 -26.7 63.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.404 -0.81 . . . . 0.0 110.33 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.9 mmtm -83.85 -40.91 18.08 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.287 -0.883 . . . . 0.0 110.801 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -108.08 -55.57 2.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.244 -0.91 . . . . 0.0 110.449 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.36 18.59 1.82 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.479 HG23 ' HD2' ' B' ' 37' ' ' PRO . 18.3 mt -91.31 143.52 28.4 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.071 -1.252 . . . . 0.0 109.69 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.479 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -68.0 133.84 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 O-C-N 123.65 1.342 . . . . 0.0 110.387 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.91 -26.48 83.19 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.65 1.342 . . . . 0.0 110.756 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.0 64.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.325 -0.86 . . . . 0.0 110.061 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 23.1 mt-30 -101.23 -0.9 35.01 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.37 -0.831 . . . . 0.0 110.629 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -94.17 140.39 29.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.163 -0.96 . . . . 0.0 110.243 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -130.08 130.43 44.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.457 -0.777 . . . . 0.0 109.956 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.923 ' HB3' HD12 ' B' ' 50' ' ' LEU . 23.1 mt -104.59 116.91 32.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.404 -0.81 . . . . 0.0 110.441 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.782 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.7 mp -121.16 134.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.493 -0.754 . . . . 0.0 109.862 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.558 ' HB2' HD23 ' B' ' 67' ' ' LEU . 57.5 t80 -140.8 152.5 45.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.469 -0.77 . . . . 0.0 109.941 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.18 27.76 0.35 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.492 -0.755 . . . . 0.0 111.25 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.03 1.64 80.09 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -110.79 137.27 48.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.044 -1.268 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -78.6 135.72 37.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.358 -0.838 . . . . 0.0 109.9 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.923 HD12 ' HB3' ' B' ' 43' ' ' LEU . 51.3 mt -83.83 138.4 33.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.384 -0.822 . . . . 0.0 110.123 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -93.64 131.02 39.34 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 110.422 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 64.3 m-20 -48.34 -27.6 2.65 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.484 -0.76 . . . . 0.0 111.059 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -7.98 86.47 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.2 mmt-85 -99.36 155.87 17.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.007 -1.29 . . . . 0.0 110.442 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.9 p -102.51 163.47 12.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.419 -0.8 . . . . 0.0 110.185 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.556 ' HA ' HD12 ' B' ' 61' ' ' ILE . 98.0 mt -53.49 -44.48 69.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.338 -0.851 . . . . 0.0 110.635 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 60.0 p -56.94 -36.85 70.73 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.333 -0.854 . . . . 0.0 110.986 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.52 -27.68 66.4 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.173 -0.955 . . . . 0.0 110.257 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.665 ' CD2' HD22 ' B' ' 50' ' ' LEU . 58.2 m-85 -100.95 27.74 5.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -0.809 . . . . 0.0 109.803 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 m120 50.74 28.33 3.54 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.544 -0.723 . . . . 0.0 110.673 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.556 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.5 mt -81.56 108.64 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.403 -0.811 . . . . 0.0 109.96 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.65 173.35 6.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.358 -0.839 . . . . 0.0 110.197 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 4.4 pttt -46.6 152.71 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.462 -0.774 . . . . 0.0 110.958 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.5 mt-10 62.67 16.49 8.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.593 -0.692 . . . . 0.0 110.555 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.58 144.97 49.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.259 -0.901 . . . . 0.0 110.117 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.9 m -107.54 107.9 18.95 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.856 . . . . 0.0 109.919 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.558 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.3 mt -102.39 160.62 14.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.116 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -108.83 134.49 51.45 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.293 -0.88 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.8 tp -107.21 133.73 51.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.246 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.443 -0.786 . . . . 0.0 110.293 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 121.21 0.529 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -74.34 -29.07 61.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.19 -0.944 . . . . 0.0 109.086 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.41 96.9 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.54 -0.864 . . . . 0.0 108.928 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 17.1 mt -64.73 -28.85 69.87 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.11 -47.54 28.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.522 -0.736 . . . . 0.0 109.842 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 -53.55 7.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.33 -0.856 . . . . 0.0 110.527 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -51.98 -39.6 59.59 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.177 -0.952 . . . . 0.0 110.714 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 34.3 m -69.2 -43.33 74.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.17 -12.65 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.136 -0.978 . . . . 0.0 110.332 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.53 -41.71 45.74 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.79 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -84.28 -23.02 30.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.416 -0.803 . . . . 0.0 110.249 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 . . . . . 0 N--CA 1.493 1.686 0 O-C-N 121.344 -0.848 . . . . 0.0 110.422 -179.895 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.6 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.354 0.597 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.563 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.5 pt-20 -67.61 -30.99 70.72 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.558 -0.713 . . . . 0.0 109.126 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 65.6 mt-10 -85.31 -40.67 16.3 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.75 -42.16 99.54 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -70.47 -35.62 73.41 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.33 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.808 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.23 96.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.484 -0.76 . . . . 0.0 109.624 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -74.05 -51.82 14.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.495 -0.753 . . . . 0.0 110.147 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.92 -37.65 80.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.453 -0.779 . . . . 0.0 110.358 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 tpt -81.57 -20.13 40.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.103 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.088 179.85 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.313 0.578 . . . . 0.0 110.349 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -119.08 137.9 53.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.512 -0.742 . . . . 0.0 109.508 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.461 HD13 HG21 ' B' ' 17' ' ' VAL . 40.1 pt -137.66 157.97 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -0.967 . . . . 0.0 110.626 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' B' ' 14' ' ' THR . 66.3 m-85 -111.91 146.85 37.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.604 -0.685 . . . . 0.0 110.364 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.488 HG11 HD11 ' B' ' 30' ' ' ILE . 66.3 t -127.78 116.55 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 109.598 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.0 136.85 39.29 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.545 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.7 p -96.02 168.3 10.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.444 -0.785 . . . . 0.0 110.063 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt -61.8 -8.84 5.34 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.315 -0.866 . . . . 0.0 111.29 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 47.7 p -95.43 -19.74 19.64 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.079 -1.013 . . . . 0.0 110.597 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.31 6.23 22.24 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 10.5 tttp -84.66 129.7 34.8 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.093 -1.239 . . . . 0.0 109.968 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.6 m -113.21 128.73 56.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.084 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 38.4 mt -109.28 141.19 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.504 -0.748 . . . . 0.0 110.406 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.422 HG23 ' CE1' ' B' ' 4' ' ' PHE . 27.6 m -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.366 -0.834 . . . . 0.0 109.176 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.414 ' CD2' ' CE ' ' B' ' 33' ' ' LYS . 35.0 mt -123.42 154.35 39.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.987 . . . . 0.0 111.137 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -106.32 114.98 29.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.443 -0.786 . . . . 0.0 109.034 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.468 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.4 m -140.01 176.76 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 111.039 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.403 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.1 mp0 -113.19 166.87 10.22 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.88 -25.73 19.62 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 O-C-N 123.493 1.26 . . . . 0.0 110.192 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.82 -1.9 57.03 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.171 -0.956 . . . . 0.0 110.552 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -71.19 140.57 50.54 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.123 -0.986 . . . . 0.0 110.567 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.9 p -83.62 159.2 21.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 110.763 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.629 HG23 HD12 ' B' ' 43' ' ' LEU . 44.1 mm -59.71 -40.57 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.42 -0.8 . . . . 0.0 109.621 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -56.85 -34.58 67.95 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 109.579 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -70.59 -33.6 71.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.514 -0.741 . . . . 0.0 109.329 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 82.0 t -69.91 -40.22 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.415 -0.803 . . . . 0.0 109.186 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -62.86 -41.32 99.32 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.419 -0.801 . . . . 0.0 109.083 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.77 74.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.537 -0.727 . . . . 0.0 109.297 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.414 ' CE ' HG12 ' B' ' 17' ' ' VAL . 6.0 mttm -68.07 -40.5 82.71 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.535 -0.728 . . . . 0.0 109.555 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.75 HD13 HD12 ' B' ' 69' ' ' LEU . 36.8 mt -66.78 -37.34 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.312 -0.868 . . . . 0.0 109.115 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.55 -47.71 84.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.418 -0.801 . . . . 0.0 109.254 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.44 -31.67 67.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.508 -0.745 . . . . 0.0 110.613 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.414 ' CE ' ' CD2' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -83.42 -36.96 23.84 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.293 -0.879 . . . . 0.0 111.262 -179.312 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -108.11 -55.86 2.32 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.106 -0.996 . . . . 0.0 110.55 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 125.88 15.37 2.9 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.474 HG23 ' HD2' ' B' ' 37' ' ' PRO . 90.6 mt -91.25 142.95 27.63 Favored Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.154 -1.203 . . . . 0.0 109.749 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.495 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.6 Cg_endo -68.22 134.79 32.43 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.638 1.336 . . . . 0.0 110.622 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.91 -25.64 81.72 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 O-C-N 123.695 1.366 . . . . 0.0 111.012 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.68 -22.01 64.4 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 109.902 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.495 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.2 mp0 -101.01 -4.25 27.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.454 -0.779 . . . . 0.0 110.513 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -94.26 142.5 27.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.07 130.99 45.59 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.421 -0.799 . . . . 0.0 109.725 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.81 ' HB3' HD12 ' B' ' 50' ' ' LEU . 24.5 mt -104.64 118.72 37.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.244 -0.91 . . . . 0.0 110.448 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.779 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.32 135.37 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.405 -0.81 . . . . 0.0 109.723 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.613 ' HB2' HD23 ' B' ' 67' ' ' LEU . 78.9 t80 -140.72 150.49 43.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.453 -0.779 . . . . 0.0 110.053 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.01 0.4 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.482 -0.761 . . . . 0.0 111.253 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.77 1.97 84.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 136.65 49.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.084 -1.245 . . . . 0.0 110.178 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -78.41 135.17 37.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.831 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.81 HD12 ' HB3' ' B' ' 43' ' ' LEU . 49.1 mt -83.79 140.72 31.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.296 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.58 131.27 39.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.346 -0.846 . . . . 0.0 110.418 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.467 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 76.7 m-20 -48.3 -32.43 7.34 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.438 -0.789 . . . . 0.0 111.051 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.07 -2.69 90.6 Favored Glycine 0 N--CA 1.493 2.492 0 C-N-CA 120.132 -1.032 . . . . 0.0 110.599 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.446 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.8 mmt85 -99.47 153.34 19.1 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.272 . . . . 0.0 110.445 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 82.6 p -102.2 164.63 11.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.451 -0.781 . . . . 0.0 110.174 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.505 HD22 HG21 ' B' ' 61' ' ' ILE . 65.8 mt -53.49 -44.82 69.35 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.28 -0.887 . . . . 0.0 110.743 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 42.3 t -56.62 -35.55 68.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.371 -0.831 . . . . 0.0 111.02 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -59.71 -28.98 67.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.296 -0.878 . . . . 0.0 110.407 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.638 ' CD2' HD22 ' B' ' 50' ' ' LEU . 64.3 m-85 -100.94 24.57 9.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.332 -0.855 . . . . 0.0 110.228 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 50.64 30.76 5.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.489 -0.757 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.505 HG21 HD22 ' B' ' 56' ' ' LEU . 86.1 mt -81.4 114.37 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.409 -0.807 . . . . 0.0 109.926 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -105.77 171.13 7.5 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.372 -0.83 . . . . 0.0 110.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.443 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.1 OUTLIER -46.62 155.11 0.26 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.548 -0.72 . . . . 0.0 111.128 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 63.38 13.11 6.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.702 -0.624 . . . . 0.0 111.003 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.9 141.38 49.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 58.7 m -107.4 115.08 29.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.321 -0.862 . . . . 0.0 109.942 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.613 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.7 mt -102.44 161.13 13.95 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -0.856 . . . . 0.0 110.378 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -108.76 136.79 47.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.312 -0.868 . . . . 0.0 109.806 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.75 HD12 HD13 ' B' ' 30' ' ' ILE . 6.9 tt -107.31 135.96 47.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.176 -0.952 . . . . 0.0 110.466 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.68 ' N ' HD23 ' B' ' 69' ' ' LEU . 47.8 t . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.758 . . . . 0.0 110.048 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 t0 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.265 0.555 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -74.96 -30.53 61.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.186 -0.947 . . . . 0.0 109.026 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -48.87 79.88 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.564 -0.855 . . . . 0.0 108.819 179.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.12 -29.89 68.92 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 tt -76.23 -35.33 59.06 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.497 0.665 . . . . 0.0 109.563 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 1.3 mttt -81.22 -58.0 3.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.427 -0.795 . . . . 0.0 110.289 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 mtt -51.0 -37.3 44.25 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.363 -0.836 . . . . 0.0 110.642 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.2 m -70.02 -44.47 69.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 110.261 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.5 tp -83.59 -11.67 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.208 -0.933 . . . . 0.0 110.437 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 3.4 m -77.33 -44.68 28.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.207 -0.933 . . . . 0.0 109.711 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.28 -24.29 37.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.523 -0.736 . . . . 0.0 110.019 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 91' ' ' GLU . 69.4 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.374 0.606 . . . . 0.0 110.166 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.599 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.15 -34.64 78.86 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.421 -0.799 . . . . 0.0 109.345 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.415 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.8 mt-10 -85.45 -40.19 16.68 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.6 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.411 ' HB2' ' OG1' ' A' ' 88' ' ' THR . 0.3 OUTLIER -65.11 -42.51 93.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 108.528 179.109 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -70.02 -34.01 72.73 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.599 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.68 -35.69 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.8 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.58 -45.52 75.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.585 -0.697 . . . . 0.0 109.551 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -67.08 -32.68 74.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.84 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.57 -34.64 35.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 110.064 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.8 mmt -83.89 -26.28 29.53 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.907 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.421 -0.799 . . . . 0.0 110.199 179.947 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.266 0.555 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -97.79 146.46 25.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.498 -0.751 . . . . 0.0 109.93 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.568 HD13 HG21 ' B' ' 17' ' ' VAL . 20.8 pt -137.56 159.03 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.34 -0.85 . . . . 0.0 110.269 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -111.93 142.25 44.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.527 -0.733 . . . . 0.0 110.545 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -127.53 117.91 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.399 -0.813 . . . . 0.0 109.602 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.4 mttm -100.2 130.5 46.34 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.411 -0.806 . . . . 0.0 110.599 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.542 HG22 ' HB3' ' B' ' 69' ' ' LEU . 61.2 p -96.01 175.26 6.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.001 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.433 HD11 HG13 ' B' ' 70' ' ' VAL . 12.7 mt -61.72 -11.31 11.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.251 -0.906 . . . . 0.0 111.039 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 62.9 p -95.72 13.82 25.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.962 -1.086 . . . . 0.0 110.791 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.64 7.84 70.36 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 21.6 tttm -84.83 130.05 34.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.985 -1.303 . . . . 0.0 109.919 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 41.7 m -113.33 125.58 54.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.359 -0.838 . . . . 0.0 110.245 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.28 136.23 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.414 -0.804 . . . . 0.0 110.417 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.4 m -102.19 120.83 41.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.301 -0.875 . . . . 0.0 109.448 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.9 mt -123.64 168.84 12.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.129 -0.982 . . . . 0.0 110.919 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -106.27 113.71 27.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.472 -0.767 . . . . 0.0 109.492 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.568 HG21 HD13 ' B' ' 3' ' ' ILE . 32.3 m -140.68 167.22 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.279 -0.888 . . . . 0.0 110.958 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.55 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -112.69 167.24 9.49 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.535 -0.728 . . . . 0.0 109.06 178.736 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.94 -26.75 18.3 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.449 1.236 . . . . 0.0 110.39 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.5 -3.15 58.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.183 -0.948 . . . . 0.0 110.523 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.07 141.92 50.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.0 110.47 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.2 p -83.26 158.04 22.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.57 -0.706 . . . . 0.0 110.345 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.716 HG22 ' CE ' ' B' ' 27' ' ' LYS . 44.5 mm -59.71 -36.41 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.349 -0.844 . . . . 0.0 109.494 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.25 -35.38 75.37 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.23 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -70.57 -31.79 68.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.461 -0.775 . . . . 0.0 109.19 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -70.11 -41.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.493 -0.754 . . . . 0.0 109.089 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.716 ' CE ' HG22 ' B' ' 23' ' ' ILE . 38.1 mttt -62.93 -42.87 99.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.476 -0.765 . . . . 0.0 109.34 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.24 -33.84 74.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.518 -0.739 . . . . 0.0 109.426 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -68.3 -39.29 82.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.506 -0.746 . . . . 0.0 109.558 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.409 HD13 HD22 ' B' ' 69' ' ' LEU . 10.5 mt -67.12 -38.96 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 119.669 -0.812 . . . . 0.0 109.18 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.65 -50.66 72.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.416 -0.802 . . . . 0.0 109.588 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.11 -25.89 61.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.375 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -84.01 -41.94 16.73 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.169 -0.957 . . . . 0.0 110.722 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -107.99 -54.51 2.49 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.16 -0.962 . . . . 0.0 110.502 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.45 21.45 1.81 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.543 HG23 ' HD2' ' B' ' 37' ' ' PRO . 15.2 mt -91.45 145.2 30.89 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.131 -1.217 . . . . 0.0 109.797 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.543 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.8 Cg_endo -67.28 131.51 25.17 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.586 1.308 . . . . 0.0 110.4 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.73 -24.59 79.16 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.676 1.356 . . . . 0.0 110.741 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.74 -25.11 64.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 109.636 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -101.28 9.78 41.37 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.574 -0.703 . . . . 0.0 110.209 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' GLN . . . . . 0.412 ' HG2' HD11 ' B' ' 69' ' ' LEU . 0.5 OUTLIER -94.25 137.04 33.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.206 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH2' HD11 ' B' ' 44' ' ' ILE . 0.1 OUTLIER -130.04 123.48 30.6 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.351 -0.843 . . . . 0.0 110.1 179.857 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.79 ' C ' HD12 ' B' ' 44' ' ' ILE . 25.0 mt -104.52 115.26 30.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.383 -0.823 . . . . 0.0 110.236 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.79 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.12 137.01 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.515 -0.74 . . . . 0.0 109.727 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -140.65 145.65 36.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.43 -0.794 . . . . 0.0 109.82 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.41 29.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.504 -0.747 . . . . 0.0 111.062 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.3 6.43 87.8 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -111.09 131.6 54.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.051 -1.264 . . . . 0.0 110.238 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -78.59 131.68 36.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.257 -0.902 . . . . 0.0 109.615 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.641 HD22 ' CG ' ' B' ' 59' ' ' TYR . 26.1 mt -83.95 139.01 32.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.904 . . . . 0.0 110.351 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.71 132.43 38.08 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.319 -0.863 . . . . 0.0 110.775 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.468 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 7.8 m-20 -48.42 -28.38 3.22 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.519 -0.738 . . . . 0.0 111.104 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.95 -6.69 88.12 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.59 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -99.38 156.27 17.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.072 -1.252 . . . . 0.0 110.45 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.8 p -102.12 162.24 13.07 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.822 . . . . 0.0 110.249 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.634 ' HA ' HD12 ' B' ' 61' ' ' ILE . 86.8 mt -53.42 -44.72 69.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.315 -0.865 . . . . 0.0 110.667 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.9 t -56.65 -34.5 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.322 -0.861 . . . . 0.0 110.991 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -59.63 -28.06 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.228 -0.92 . . . . 0.0 110.403 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.641 ' CG ' HD22 ' B' ' 50' ' ' LEU . 73.9 m-85 -101.18 27.42 6.15 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.382 -0.824 . . . . 0.0 109.958 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 m120 50.94 31.85 6.72 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.46 -0.775 . . . . 0.0 110.757 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.634 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.6 mt -81.7 113.8 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.049 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -105.72 167.93 9.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.367 -0.833 . . . . 0.0 110.122 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 12.2 pttp -46.46 153.09 0.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.496 -0.752 . . . . 0.0 110.918 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.4 OUTLIER 62.48 16.8 8.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.595 -0.691 . . . . 0.0 110.511 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.51 146.18 48.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 110.302 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -107.67 109.17 20.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.391 -0.818 . . . . 0.0 109.957 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.507 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.56 162.78 12.65 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.293 -0.88 . . . . 0.0 110.075 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -108.75 131.2 55.17 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.215 -0.928 . . . . 0.0 109.906 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.542 ' HB3' HG22 ' B' ' 7' ' ' THR . 57.6 tp -107.17 128.09 54.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 0.0 110.385 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.433 HG13 HD11 ' B' ' 8' ' ' LEU . 47.2 t . . . . . 0 N--CA 1.493 1.677 0 O-C-N 121.428 -0.795 . . . . 0.0 110.007 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t0 . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.291 0.567 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -76.11 -29.77 58.0 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.296 -0.877 . . . . 0.0 109.131 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.47 96.8 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.796 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -29.2 70.26 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -40.21 55.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.466 -0.771 . . . . 0.0 109.87 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HA ' HG22 ' A' ' 71' ' ' ILE . 10.8 mmtp -81.79 -55.28 4.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.387 -0.821 . . . . 0.0 110.516 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 tpp -52.37 -42.42 63.95 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.152 -0.968 . . . . 0.0 110.604 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 84.7 m -68.02 -42.86 80.01 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.311 -0.868 . . . . 0.0 110.559 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.415 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.3 tp -82.5 -12.99 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.231 -0.918 . . . . 0.0 110.413 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.9 m -76.08 -39.43 55.37 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.338 -0.851 . . . . 0.0 109.749 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -84.35 -27.09 27.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.416 -0.802 . . . . 0.0 110.079 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.941 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.6 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.282 0.563 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.575 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.3 pt-20 -71.52 -32.36 68.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.457 -0.777 . . . . 0.0 109.207 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 26.7 mt-10 -85.24 -38.18 19.21 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.272 179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -43.21 89.19 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -68.07 -35.23 77.86 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.575 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.81 -37.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.788 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.46 -33.35 74.66 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.496 -0.752 . . . . 0.0 109.823 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -75.78 -31.66 59.58 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.36 -32.44 29.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.457 -0.777 . . . . 0.0 110.167 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.54 -29.77 27.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.36 -0.837 . . . . 0.0 109.689 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.373 -0.829 . . . . 0.0 109.915 179.854 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.435 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.4 ttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.253 0.549 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 140.68 29.48 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.33 -0.856 . . . . 0.0 109.725 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.41 158.06 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.235 -0.915 . . . . 0.0 110.32 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.81 143.85 42.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.71 -0.619 . . . . 0.0 110.681 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 64.1 t -127.99 124.58 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 109.517 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 13.1 mttt -99.88 134.11 43.27 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.423 -0.798 . . . . 0.0 110.291 -179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 40.3 p -95.47 172.89 7.8 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.331 -0.856 . . . . 0.0 110.302 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.475 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.6 mm? -61.26 -13.54 19.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.486 -0.759 . . . . 0.0 111.034 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.5 p -95.72 -5.77 41.36 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.026 -1.046 . . . . 0.0 110.997 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.99 9.43 57.21 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.1 OUTLIER -84.62 136.53 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.259 . . . . 0.0 109.779 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 31.0 m -113.07 127.32 56.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.229 -0.919 . . . . 0.0 110.373 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.29 137.27 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 23.3 m -102.09 120.68 40.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.3 mt -123.48 158.59 30.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.095 -1.003 . . . . 0.0 110.918 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -106.29 113.8 27.54 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 109.385 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.62 HG12 ' HD3' ' B' ' 29' ' ' LYS . 34.0 m -140.29 177.4 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.266 -0.896 . . . . 0.0 110.938 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.52 ' O ' HD12 ' B' ' 56' ' ' LEU . 18.3 mt-10 -113.03 164.61 15.07 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.89 -27.27 17.87 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.523 1.275 . . . . 0.0 110.282 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.63 -1.34 55.9 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.885 . . . . 0.0 110.735 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.99 143.87 50.67 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.073 -1.017 . . . . 0.0 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 81.1 p -83.4 159.15 21.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.491 -0.756 . . . . 0.0 110.606 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 44.7 mm -59.62 -37.45 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.381 -0.824 . . . . 0.0 109.461 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -60.22 -34.67 73.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.422 -0.799 . . . . 0.0 109.358 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.47 -33.77 71.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.0 109.264 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.1 t -70.04 -40.06 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.454 -0.779 . . . . 0.0 109.26 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -62.9 -42.62 99.85 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.462 -0.774 . . . . 0.0 109.206 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.56 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.481 -0.762 . . . . 0.0 109.368 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.62 ' HD3' HG12 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -68.15 -39.8 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.567 -0.708 . . . . 0.0 109.535 179.408 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.553 HD13 HD22 ' B' ' 69' ' ' LEU . 17.8 mt -67.01 -37.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.96 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 50.0 tt0 -60.77 -50.57 72.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.377 -0.827 . . . . 0.0 109.374 178.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -58.07 -27.72 63.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 110.517 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -83.93 -39.04 20.29 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.307 -0.871 . . . . 0.0 110.778 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -108.07 -56.85 2.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 127.23 19.19 1.96 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.079 -1.209 . . . . 0.0 110.079 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.518 HG23 ' HD2' ' B' ' 37' ' ' PRO . 25.2 mt -91.43 144.03 29.06 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.092 -1.24 . . . . 0.0 109.93 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.518 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.6 Cg_endo -68.28 132.3 25.5 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.714 1.376 . . . . 0.0 110.459 179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.67 -25.12 80.28 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.736 1.387 . . . . 0.0 110.816 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -26.15 64.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.418 -0.801 . . . . 0.0 109.84 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.439 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.6 mm100 -101.24 2.5 39.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.446 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -94.21 139.65 30.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.09 129.05 43.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.38 -0.825 . . . . 0.0 110.15 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.907 ' HB3' HD12 ' B' ' 50' ' ' LEU . 17.4 mt -104.71 118.57 36.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.797 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.09 135.09 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.436 -0.79 . . . . 0.0 109.992 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -140.73 149.5 42.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.606 -0.684 . . . . 0.0 109.543 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 28.46 0.52 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.423 -0.798 . . . . 0.0 111.088 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.36 2.1 78.14 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -111.04 136.79 49.52 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.093 -1.239 . . . . 0.0 110.215 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -78.4 138.99 38.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.227 -0.921 . . . . 0.0 109.824 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.907 HD12 ' HB3' ' B' ' 43' ' ' LEU . 47.9 mt -83.68 140.8 31.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.374 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.56 128.15 39.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.409 -0.807 . . . . 0.0 110.429 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 75.4 m-20 -48.35 -29.88 4.39 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.472 -0.767 . . . . 0.0 111.127 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.92 -5.19 89.58 Favored Glycine 0 N--CA 1.493 2.498 0 C-N-CA 120.121 -1.038 . . . . 0.0 110.622 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt-85 -99.34 155.97 17.24 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.983 -1.304 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.7 p -102.46 165.4 11.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.393 -0.817 . . . . 0.0 110.232 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.52 HD12 ' O ' ' B' ' 18' ' ' GLU . 64.9 mt -53.78 -47.62 70.57 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 29.1 t -56.75 -35.95 69.22 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.333 -0.854 . . . . 0.0 111.18 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -59.47 -27.38 66.06 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.107 -0.995 . . . . 0.0 110.236 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.473 ' CD2' HD22 ' B' ' 50' ' ' LEU . 34.2 m-85 -101.37 27.96 5.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.394 -0.816 . . . . 0.0 109.919 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 50.72 26.51 2.56 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.513 -0.742 . . . . 0.0 110.829 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.52 HD13 HD21 ' B' ' 67' ' ' LEU . 96.4 mt -81.53 109.56 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.274 -0.891 . . . . 0.0 109.906 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -105.68 173.38 6.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.379 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.7 151.72 0.56 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 111.088 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 35.0 mt-10 63.0 16.33 9.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.768 -0.582 . . . . 0.0 110.616 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.4 144.61 49.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 12.6 m -107.4 108.46 19.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 109.821 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.52 HD21 HD13 ' B' ' 61' ' ' ILE . 1.9 mt -102.31 160.29 14.66 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.318 -0.864 . . . . 0.0 110.041 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -108.95 132.89 53.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.278 -0.889 . . . . 0.0 110.151 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.553 HD22 HD13 ' B' ' 30' ' ' ILE . 61.8 tp -107.21 130.94 54.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.861 . . . . 0.0 109.95 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 16.6 t . . . . . 0 N--CA 1.492 1.655 0 O-C-N 121.452 -0.78 . . . . 0.0 110.155 -179.935 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.238 0.542 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -76.23 -28.24 57.1 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.205 -0.934 . . . . 0.0 109.221 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.7 99.62 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.584 -0.846 . . . . 0.0 108.882 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.85 -29.66 69.63 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -76.58 -37.53 56.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.578 -0.701 . . . . 0.0 109.871 179.248 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.457 ' HA ' HG22 ' A' ' 71' ' ' ILE . 21.5 mmtm -83.87 -55.24 4.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 110.361 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.9 tpt -52.86 -42.75 65.52 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.7 m -69.96 -41.85 73.95 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.457 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.8 tp -83.77 -12.08 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 110.59 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 68' ' ' LYS . 83.5 p -78.78 -45.42 21.06 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.175 -0.953 . . . . 0.0 109.801 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -82.97 -18.78 38.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.499 -0.751 . . . . 0.0 110.267 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.184 -0.947 . . . . 0.0 110.677 -179.742 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.496 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.6 p . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.382 0.611 . . . . 0.0 110.433 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 pt-20 -70.78 -30.04 66.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.514 -0.741 . . . . 0.0 109.149 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.453 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 6.9 mt-10 -83.44 -38.37 21.97 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.496 ' HB2' ' N ' ' A' ' 88' ' ' THR . 69.5 mm-40 -65.37 -43.69 89.98 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -66.95 -35.27 79.6 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.99 -36.95 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.77 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.96 81.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.79 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.18 -54.52 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.072 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.3 -34.15 74.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.5 ttp -80.91 -25.28 37.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.799 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.427 -0.796 . . . . 0.0 109.997 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.442 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.3 ttp . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.21 0.528 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.69 140.55 29.41 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.405 -0.81 . . . . 0.0 109.708 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.654 HD13 HG21 ' B' ' 17' ' ' VAL . 42.6 pt -137.33 158.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.19 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -111.67 145.88 38.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.557 -0.714 . . . . 0.0 110.427 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' B' ' 12' ' ' THR . 61.7 t -127.89 122.55 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.452 -0.78 . . . . 0.0 109.95 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.473 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.38 128.51 46.43 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.515 -0.741 . . . . 0.0 110.257 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.505 HG22 HD23 ' B' ' 69' ' ' LEU . 66.8 p -95.74 177.51 5.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.371 -0.83 . . . . 0.0 110.473 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.471 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.6 mm? -61.12 -16.98 50.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.44 -0.788 . . . . 0.0 110.841 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.6 p -96.04 21.71 8.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.065 -1.022 . . . . 0.0 110.661 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.6 15.96 58.13 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.9 ttpm? -84.73 131.58 34.55 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.128 -1.219 . . . . 0.0 109.821 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 22.5 m -112.84 125.21 54.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.402 HD13 HG21 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -109.65 141.52 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.399 -0.813 . . . . 0.0 110.258 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.613 ' C ' HD12 ' B' ' 15' ' ' LEU . 7.4 m -101.94 120.06 39.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.295 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.613 HD12 ' C ' ' B' ' 14' ' ' THR . 7.2 mp -123.24 159.64 28.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.211 -0.931 . . . . 0.0 110.978 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.62 114.96 29.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 109.317 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.654 HG21 HD13 ' B' ' 3' ' ' ILE . 32.7 m -140.15 172.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.241 -0.912 . . . . 0.0 110.883 -179.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.576 ' O ' HD12 ' B' ' 56' ' ' LEU . 3.4 mp0 -112.86 165.1 13.82 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.54 -28.29 17.79 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.587 1.309 . . . . 0.0 110.384 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -84.66 -2.14 57.09 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.199 -0.938 . . . . 0.0 110.649 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.14 141.67 50.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.22 -0.925 . . . . 0.0 110.538 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.0 p -83.36 159.77 21.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 110.378 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.4 mm -59.93 -35.46 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.377 -0.827 . . . . 0.0 109.773 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -60.83 -38.04 84.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.828 . . . . 0.0 109.587 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -69.95 -31.51 69.29 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 109.195 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 22' ' ' THR . 67.2 t -70.1 -39.8 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.0 109.086 179.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.05 -42.16 99.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.565 -0.709 . . . . 0.0 109.144 179.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.27 -34.74 75.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.5 -0.75 . . . . 0.0 109.243 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.523 ' HD3' HG12 ' B' ' 17' ' ' VAL . 17.6 mttp -68.13 -35.48 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.328 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.2 mt -67.71 -42.04 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.447 -0.783 . . . . 0.0 109.279 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 11.4 tt0 -60.11 -49.58 77.09 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.805 . . . . 0.0 109.445 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.35 -25.81 62.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.379 -0.826 . . . . 0.0 110.393 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -84.04 -43.97 14.59 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.262 -0.898 . . . . 0.0 110.873 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -107.99 -50.29 3.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.219 -0.926 . . . . 0.0 110.631 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.55 18.23 3.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 110.074 -1.211 . . . . 0.0 110.074 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.545 HG23 ' HD2' ' B' ' 37' ' ' PRO . 91.0 mt -91.28 145.32 31.26 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.133 -1.216 . . . . 0.0 109.735 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.545 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.2 Cg_endo -67.75 133.93 31.02 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.579 1.304 . . . . 0.0 110.505 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.71 -25.94 81.97 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.781 1.411 . . . . 0.0 110.746 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.7 -21.98 64.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.785 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.424 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.2 mt-30 -101.18 0.59 37.86 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.463 -0.773 . . . . 0.0 110.337 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -94.25 138.51 32.18 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.892 . . . . 0.0 110.472 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.501 ' C ' HD22 ' B' ' 43' ' ' LEU . 1.2 mtt85 -130.06 128.53 42.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.715 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.776 ' C ' HD12 ' B' ' 44' ' ' ILE . 4.5 mm? -104.44 114.94 29.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.367 -0.833 . . . . 0.0 110.37 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.776 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.23 134.07 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.561 -0.712 . . . . 0.0 109.811 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -140.92 148.6 40.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.421 -0.799 . . . . 0.0 109.95 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.49 28.57 0.51 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 111.134 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.58 2.16 84.38 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.03 130.99 55.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.117 -1.225 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -78.52 136.68 37.62 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.318 -0.864 . . . . 0.0 109.814 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.753 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.4 mt -83.99 141.09 31.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.302 -0.874 . . . . 0.0 110.303 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -93.79 133.12 37.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.357 -0.84 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.515 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 15.8 m-20 -48.17 -30.62 4.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.514 -0.741 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -5.51 89.21 Favored Glycine 0 N--CA 1.494 2.548 0 C-N-CA 120.159 -1.019 . . . . 0.0 110.732 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.446 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.1 mmt-85 -99.28 155.12 17.67 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.053 -1.263 . . . . 0.0 110.477 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.5 p -102.16 163.97 11.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.46 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.576 HD12 ' O ' ' B' ' 18' ' ' GLU . 83.5 mt -53.69 -45.44 70.37 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.352 -0.843 . . . . 0.0 110.877 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 18.2 t -56.58 -34.2 66.93 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.408 -0.807 . . . . 0.0 110.956 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -59.7 -27.79 66.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.753 ' CD2' HD22 ' B' ' 50' ' ' LEU . 76.7 m-85 -101.19 26.0 7.58 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -0.844 . . . . 0.0 110.166 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 50.68 30.4 4.9 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.436 -0.79 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.502 HD13 HD21 ' B' ' 67' ' ' LEU . 94.7 mt -81.41 113.64 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.215 -0.928 . . . . 0.0 109.84 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -105.68 170.44 7.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.366 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.1 pttt -46.71 152.46 0.48 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.5 -0.75 . . . . 0.0 111.11 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.4 mm-40 63.31 15.03 8.34 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.688 -0.632 . . . . 0.0 110.696 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.74 144.47 49.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.147 -0.97 . . . . 0.0 110.073 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -107.44 113.18 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.81 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.502 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.39 162.45 12.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.4 -0.813 . . . . 0.0 110.125 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -108.74 132.59 53.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 109.665 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.505 HD23 HG22 ' B' ' 7' ' ' THR . 42.7 tp -106.89 131.25 54.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 110.314 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 45.6 t . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.417 -0.802 . . . . 0.0 110.289 -179.902 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.1 t0 . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 121.257 0.551 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -78.14 -32.9 50.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.169 -0.957 . . . . 0.0 109.471 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.49 -37.06 82.28 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.402 -0.919 . . . . 0.0 108.736 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.456 ' O ' HG23 ' A' ' 70' ' ' THR . 5.9 mt -69.55 -31.44 69.63 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.14 -43.89 55.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.583 -0.698 . . . . 0.0 109.576 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -75.9 -53.42 8.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.497 -0.752 . . . . 0.0 110.094 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.0 ttt -49.36 -37.34 24.47 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.256 -0.903 . . . . 0.0 110.743 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.456 HG23 ' O ' ' A' ' 66' ' ' LEU . 15.5 p -71.09 -39.59 72.05 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.334 -0.854 . . . . 0.0 110.526 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.411 HG22 ' O ' ' A' ' 68' ' ' LYS . 5.1 tp -83.93 -16.82 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.256 -0.903 . . . . 0.0 110.289 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.87 -41.19 60.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.946 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -86.63 -19.24 29.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.46 -0.775 . . . . 0.0 110.28 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.28 -0.887 . . . . 0.0 110.338 179.946 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.481 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 81.4 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.321 0.581 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.556 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.4 mt-10 -75.82 -29.26 58.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.447 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 2.6 mp0 -85.48 -36.53 20.5 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.481 ' HB2' ' N ' ' A' ' 88' ' ' THR . 63.1 mm-40 -66.26 -44.35 83.87 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.556 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -70.64 -33.69 54.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.737 -0.602 . . . . 0.0 109.401 178.92 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.19 91.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.432 -0.793 . . . . 0.0 110.051 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -37.22 21.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 109.967 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.17 -37.88 81.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.271 -0.893 . . . . 0.0 110.185 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.2 ttt -81.51 -22.56 37.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.948 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 110.094 -179.952 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 44.6 ttp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -92.65 139.42 30.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.359 -0.838 . . . . 0.0 109.79 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.6 158.18 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 110.348 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -112.0 144.36 41.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.567 -0.708 . . . . 0.0 110.779 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.79 118.23 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.488 -0.757 . . . . 0.0 109.588 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 34.2 mttt -100.25 129.9 46.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.422 -0.798 . . . . 0.0 110.578 -179.484 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.54 HG22 ' HB3' ' B' ' 69' ' ' LEU . 40.0 p -96.13 174.98 6.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.377 -0.827 . . . . 0.0 110.136 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.47 -13.6 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.335 -0.853 . . . . 0.0 111.056 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.2 p -95.72 18.13 13.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.099 -1.0 . . . . 0.0 110.698 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.28 11.62 61.94 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.0 tttp -84.96 127.76 34.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.055 -1.262 . . . . 0.0 109.895 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.9 m -112.94 125.15 54.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.264 -0.898 . . . . 0.0 110.272 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 31.6 mt -109.51 138.65 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.464 -0.773 . . . . 0.0 110.492 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.4 m -102.59 121.21 41.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.774 . . . . 0.0 109.452 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.53 HD23 ' HE3' ' B' ' 33' ' ' LYS . 49.1 mt -123.75 161.41 25.23 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.127 -0.983 . . . . 0.0 111.163 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -106.31 114.59 28.8 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.536 -0.727 . . . . 0.0 109.27 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.532 HG12 ' CE ' ' B' ' 29' ' ' LYS . 33.9 m -140.2 175.52 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.282 -0.886 . . . . 0.0 110.85 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.63 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.5 mp0 -113.36 165.88 12.38 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.91 -27.37 17.7 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 O-C-N 123.453 1.238 . . . . 0.0 110.234 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.68 -1.57 56.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.144 -0.972 . . . . 0.0 110.518 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -71.26 143.22 50.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.213 -0.929 . . . . 0.0 110.477 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 75.9 p -83.24 158.24 22.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.597 -0.689 . . . . 0.0 110.396 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.572 HG23 HD12 ' B' ' 43' ' ' LEU . 42.8 mm -59.71 -37.58 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 109.413 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -60.0 -34.59 73.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.427 -0.796 . . . . 0.0 109.148 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -70.33 -31.86 69.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.546 -0.721 . . . . 0.0 109.198 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.93 -39.77 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -62.85 -41.73 99.47 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.43 -33.2 73.31 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.551 -0.718 . . . . 0.0 109.229 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.532 ' CE ' HG12 ' B' ' 17' ' ' VAL . 7.2 mttp -68.43 -38.56 81.32 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.991 -0.684 . . . . 0.0 109.504 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.459 HD13 HD22 ' B' ' 69' ' ' LEU . 12.5 mt -67.41 -40.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.313 -0.867 . . . . 0.0 109.33 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -60.44 -49.36 77.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.299 -0.876 . . . . 0.0 109.574 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -58.05 -28.2 64.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.504 -0.747 . . . . 0.0 110.46 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.53 ' HE3' HD23 ' B' ' 15' ' ' LEU . 12.8 mmtt -83.61 -43.11 15.99 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.387 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -108.13 -116.98 0.27 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.36 -0.838 . . . . 0.0 109.842 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.67 22.1 0.21 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 83.0 mt -91.94 141.44 25.39 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.149 -1.206 . . . . 0.0 109.982 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.571 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.5 Cg_endo -71.71 139.16 33.27 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.637 1.336 . . . . 0.0 110.217 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.62 -27.16 84.34 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 O-C-N 123.675 1.355 . . . . 0.0 111.075 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -68.77 -23.6 64.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.287 -0.883 . . . . 0.0 109.904 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.571 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 5.8 mp0 -100.98 2.79 40.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.418 -0.801 . . . . 0.0 110.661 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -94.17 136.51 34.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.178 -0.951 . . . . 0.0 110.5 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -130.21 128.42 41.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.476 -0.765 . . . . 0.0 109.789 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.909 ' HB3' HD12 ' B' ' 50' ' ' LEU . 19.2 mt -104.54 118.51 36.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.303 -0.873 . . . . 0.0 110.336 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.23 133.67 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.533 -0.729 . . . . 0.0 109.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.5 ' HB2' HD23 ' B' ' 67' ' ' LEU . 31.0 t80 -140.77 152.44 45.23 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.367 -0.833 . . . . 0.0 109.995 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.417 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.14 27.43 0.31 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.459 -0.776 . . . . 0.0 111.118 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.73 1.16 83.07 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -110.95 138.05 47.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -1.21 . . . . 0.0 110.226 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -78.7 136.01 37.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.333 -0.854 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.909 HD12 ' HB3' ' B' ' 43' ' ' LEU . 57.5 mt -83.63 139.55 32.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.188 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 129.06 40.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.396 -0.815 . . . . 0.0 110.404 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.478 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 11.8 m-20 -48.4 -27.3 2.53 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.418 -0.801 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.61 86.97 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.118 -1.039 . . . . 0.0 110.564 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.438 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 21.0 mmt180 -99.23 155.8 17.3 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.988 -1.301 . . . . 0.0 110.428 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.3 p -102.2 165.22 11.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.385 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.63 HD12 ' O ' ' B' ' 18' ' ' GLU . 87.9 mt -53.59 -44.6 69.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.358 -0.839 . . . . 0.0 110.673 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.2 t -56.61 -36.49 69.48 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.451 -0.781 . . . . 0.0 110.865 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.89 -27.71 66.94 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.236 -0.915 . . . . 0.0 110.418 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.606 ' CG ' HD22 ' B' ' 50' ' ' LEU . 71.2 m-85 -101.12 25.28 8.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.352 -0.842 . . . . 0.0 110.209 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 30.1 m120 50.66 30.94 5.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.378 -0.826 . . . . 0.0 110.554 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.621 HD12 ' HA ' ' B' ' 56' ' ' LEU . 89.1 mt -81.38 112.54 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.856 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -105.65 169.35 8.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.366 -0.834 . . . . 0.0 110.191 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 7.5 pttm -46.51 152.7 0.43 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.582 -0.699 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 61.1 mm-40 63.08 15.42 8.47 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.768 -0.583 . . . . 0.0 110.719 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.92 49.84 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.191 -0.943 . . . . 0.0 110.078 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 17.7 m -107.62 110.74 22.69 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.989 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.5 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.2 mt -102.46 164.29 11.75 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.355 -0.84 . . . . 0.0 110.169 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 67.1 m80 -108.93 132.76 53.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' B' ' 7' ' ' THR . 57.0 tp -107.3 130.34 54.78 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.23 -0.919 . . . . 0.0 110.478 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 N--CA 1.492 1.672 0 O-C-N 121.403 -0.811 . . . . 0.0 110.01 179.866 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.7 t70 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 121.203 0.525 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.0 -29.04 60.76 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.193 -0.942 . . . . 0.0 109.145 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.55 96.43 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.597 -0.841 . . . . 0.0 108.855 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tp -64.78 -28.52 69.63 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 tt -74.69 -47.71 30.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.52 -0.737 . . . . 0.0 109.875 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.01 -52.61 8.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.484 -0.76 . . . . 0.0 110.617 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.4 ttp -51.89 -38.86 57.76 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.226 -0.921 . . . . 0.0 110.65 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.5 m -70.31 -42.28 72.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.325 -0.86 . . . . 0.0 110.357 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.4 HD12 ' HA ' ' A' ' 71' ' ' ILE . 4.7 tp -81.53 -15.62 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.191 -0.943 . . . . 0.0 110.081 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -74.16 -39.89 62.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.394 -0.816 . . . . 0.0 109.672 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -80.88 -29.3 35.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.476 -0.765 . . . . 0.0 109.862 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.41 -0.806 . . . . 0.0 110.105 179.823 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.1 p . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.262 0.553 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.6 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.9 pt-20 -65.06 -32.77 74.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.548 -0.72 . . . . 0.0 109.356 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.43 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.5 mt-10 -85.32 -41.2 15.72 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 120.074 -0.65 . . . . 0.0 109.362 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -63.95 -39.89 95.18 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -71.8 -35.13 69.89 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.6 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -63.19 -41.1 91.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.846 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.411 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -62.26 -31.11 71.64 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -82.97 -36.06 25.42 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.737 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.98 -35.55 66.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.445 -0.784 . . . . 0.0 110.037 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.1 ppp? -79.22 -25.65 42.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.457 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 . . . . . 0 N--CA 1.488 1.43 0 O-C-N 121.451 -0.781 . . . . 0.0 109.849 179.821 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.334 0.588 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -97.47 146.38 25.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -0.783 . . . . 0.0 110.035 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.572 HD13 HG21 ' B' ' 17' ' ' VAL . 24.1 pt -137.53 157.4 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 110.025 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -111.68 143.59 42.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.686 -0.634 . . . . 0.0 110.638 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 12' ' ' THR . 59.0 t -127.78 118.56 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.42 -0.8 . . . . 0.0 109.405 179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.3 mtpt -100.1 138.05 37.71 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.365 -0.835 . . . . 0.0 110.574 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 42.5 p -96.14 170.13 9.48 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.455 -0.778 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.62 HD11 HG13 ' B' ' 70' ' ' VAL . 17.5 mt -61.7 -10.58 8.96 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.407 -0.808 . . . . 0.0 111.181 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.3 p -95.29 -24.38 16.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.961 -1.087 . . . . 0.0 110.507 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.6 7.31 10.9 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.4 tttp -84.64 128.56 34.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.057 -1.26 . . . . 0.0 109.943 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 27.4 m -113.16 125.29 54.18 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 110.198 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.19 135.67 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.41 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 7.1 m -102.43 119.26 38.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 109.532 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.3 mt -123.58 166.97 14.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.107 -0.996 . . . . 0.0 110.859 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -106.5 114.63 28.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 109.382 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.572 HG21 HD13 ' B' ' 3' ' ' ILE . 33.0 m -140.39 169.53 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.991 -179.227 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.537 ' O ' HD12 ' B' ' 56' ' ' LEU . 27.4 mt-10 -112.46 166.18 11.52 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.512 -0.742 . . . . 0.0 109.101 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.48 -26.44 20.16 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.499 1.263 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.63 -2.4 57.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.133 -0.979 . . . . 0.0 110.474 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -71.28 141.35 50.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.157 -0.964 . . . . 0.0 110.396 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 44.0 p -83.43 157.51 22.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.542 -0.724 . . . . 0.0 110.385 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.574 HG23 HD12 ' B' ' 43' ' ' LEU . 39.9 mm -59.55 -31.18 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.259 -0.901 . . . . 0.0 109.529 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.93 -36.91 85.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.486 -0.759 . . . . 0.0 109.377 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -32.89 70.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.486 -0.759 . . . . 0.0 109.206 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.02 -39.86 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.434 -0.791 . . . . 0.0 109.126 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.456 ' HE2' HG22 ' B' ' 23' ' ' ILE . 6.4 mttm -63.02 -42.39 99.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.49 -0.756 . . . . 0.0 109.147 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.01 74.72 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.538 -0.726 . . . . 0.0 109.392 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -68.31 -39.74 81.93 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.459 -0.776 . . . . 0.0 109.616 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.473 HD13 HD22 ' B' ' 69' ' ' LEU . 13.3 mt -67.2 -38.8 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.373 -0.829 . . . . 0.0 109.248 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -52.41 65.24 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.473 -0.767 . . . . 0.0 109.768 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -58.09 -26.69 62.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.412 -0.805 . . . . 0.0 110.575 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.1 mmtm -83.97 -39.01 20.25 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.25 -0.906 . . . . 0.0 110.986 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -107.97 -54.89 2.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.208 -0.933 . . . . 0.0 110.501 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.75 14.28 2.34 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.492 HG23 ' HD2' ' B' ' 37' ' ' PRO . 23.0 mt -91.28 143.35 28.17 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.007 -1.29 . . . . 0.0 109.756 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.3 Cg_endo -69.88 137.06 34.23 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 123.665 1.35 . . . . 0.0 110.501 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.77 -27.04 84.16 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 O-C-N 123.728 1.383 . . . . 0.0 111.197 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.65 -22.62 64.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.262 -0.899 . . . . 0.0 109.88 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.531 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.5 mp0 -101.12 -1.87 32.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.417 -0.802 . . . . 0.0 110.518 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.01 140.95 29.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.181 -0.949 . . . . 0.0 110.492 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.13 127.62 40.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 109.853 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.773 ' C ' HD12 ' B' ' 44' ' ' ILE . 19.2 mt -104.58 118.17 35.92 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.93 . . . . 0.0 110.223 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.773 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.2 137.95 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.493 -0.755 . . . . 0.0 109.821 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.79 147.83 39.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.438 -0.789 . . . . 0.0 109.795 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 29.05 0.54 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.407 -0.808 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.13 6.01 87.41 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 110.621 -0.991 . . . . 0.0 110.621 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mtmm -110.96 134.44 52.58 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.054 -1.262 . . . . 0.0 110.293 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -78.38 131.07 36.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.866 . . . . 0.0 109.542 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.708 HD12 ' HB3' ' B' ' 43' ' ' LEU . 38.7 mt -83.65 135.55 34.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -93.5 132.88 37.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.396 -0.815 . . . . 0.0 110.578 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.452 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.2 m-20 -48.38 -26.29 2.0 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.588 -0.695 . . . . 0.0 111.165 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.8 -7.81 86.8 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.5 mmt-85 -99.54 154.23 18.41 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.266 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 23.3 p -102.4 164.18 11.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.374 -0.828 . . . . 0.0 110.174 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' B' ' 61' ' ' ILE . 92.8 mt -53.53 -43.35 68.29 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.266 -0.896 . . . . 0.0 110.671 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 13.2 t -56.81 -36.24 69.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.402 -0.811 . . . . 0.0 110.971 -179.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.62 -27.75 66.59 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.231 -0.918 . . . . 0.0 110.398 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.599 ' CG ' HD22 ' B' ' 50' ' ' LEU . 80.3 m-85 -100.92 25.83 7.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.228 -0.92 . . . . 0.0 110.068 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 50.65 30.31 4.8 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.589 HD13 HD21 ' B' ' 67' ' ' LEU . 90.9 mt -81.35 113.07 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.402 -0.811 . . . . 0.0 109.934 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -105.58 171.82 7.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.452 -0.78 . . . . 0.0 110.179 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 pttp -46.51 152.39 0.46 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.487 -0.758 . . . . 0.0 111.0 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 5.1 mt-10 62.74 16.35 8.9 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.693 -0.63 . . . . 0.0 110.639 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.05 49.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.041 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.3 m -107.62 111.1 23.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.344 -0.848 . . . . 0.0 109.977 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.589 HD21 HD13 ' B' ' 61' ' ' ILE . 1.3 mt -102.55 164.92 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.325 -0.86 . . . . 0.0 110.13 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -108.79 132.37 54.05 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.301 -0.874 . . . . 0.0 110.186 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.473 HD22 HD13 ' B' ' 30' ' ' ILE . 59.6 tp -107.3 131.4 54.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.346 -0.846 . . . . 0.0 110.255 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.62 HG13 HD11 ' B' ' 8' ' ' LEU . 39.5 t . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 121.168 0.508 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.84 -32.08 57.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.252 -0.905 . . . . 0.0 109.29 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.28 82.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.49 -0.884 . . . . 0.0 108.784 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -70.51 -29.43 65.93 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.452 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.0 tt -76.88 -40.89 45.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.55 -0.719 . . . . 0.0 109.874 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HA ' HG22 ' A' ' 71' ' ' ILE . 4.0 tptt -82.97 -50.17 8.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.403 -0.811 . . . . 0.0 110.529 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.5 tpt -57.46 -40.59 78.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.6 m -69.72 -40.57 76.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.271 -0.893 . . . . 0.0 110.414 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.3 tp -83.66 -16.5 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 O-C-N 121.215 -0.928 . . . . 0.0 110.288 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -73.91 -42.03 61.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.252 -0.905 . . . . 0.0 109.782 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -81.51 -26.12 35.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.44 -0.787 . . . . 0.0 110.026 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.444 -0.785 . . . . 0.0 110.237 179.887 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.332 0.586 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 pt-20 -66.1 -32.42 73.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.617 -0.677 . . . . 0.0 109.317 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.441 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.2 mp0 -85.3 -40.36 16.65 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.26 -41.43 99.04 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -71.14 -35.4 71.68 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.568 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.9 -38.7 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.925 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -34.42 78.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.455 -0.778 . . . . 0.0 109.736 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -80.0 -44.23 20.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.417 -0.802 . . . . 0.0 110.16 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.32 -31.7 67.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.294 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 56.2 tpp -82.54 -20.81 35.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.365 -0.835 . . . . 0.0 109.981 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 110.096 179.902 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.438 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.153 0.501 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -87.65 140.42 29.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.371 -0.831 . . . . 0.0 109.882 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.1 pt -137.64 159.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -0.859 . . . . 0.0 110.614 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.406 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 81.1 m-85 -111.96 142.19 44.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.647 -0.658 . . . . 0.0 110.551 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.3 t -128.17 125.08 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.431 -0.793 . . . . 0.0 109.723 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.23 130.12 46.32 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.439 -0.788 . . . . 0.0 110.514 -179.652 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.595 HG22 HD23 ' B' ' 69' ' ' LEU . 19.7 p -95.79 177.66 5.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.44 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -16.19 42.18 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.431 -0.793 . . . . 0.0 111.007 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.9 19.59 11.24 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.038 -1.039 . . . . 0.0 110.693 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.9 12.8 58.17 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.2 OUTLIER -84.92 133.37 34.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.073 -1.251 . . . . 0.0 109.825 179.624 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.423 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 10.3 m -113.21 125.59 54.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 16.2 mt -109.13 136.67 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.384 -0.823 . . . . 0.0 110.466 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.406 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 11.4 m -102.19 118.52 37.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.412 -0.805 . . . . 0.0 109.222 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.0 mt -123.27 165.29 17.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.137 -0.977 . . . . 0.0 110.883 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -106.35 117.12 33.21 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.381 -0.825 . . . . 0.0 109.743 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.546 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.4 m -140.42 176.21 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.331 -0.856 . . . . 0.0 110.712 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.561 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.8 mp0 -113.06 163.86 16.98 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.571 -0.706 . . . . 0.0 109.137 178.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.06 -27.17 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.507 1.267 . . . . 0.0 110.332 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.3 p -84.71 -3.11 58.4 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.099 -1.0 . . . . 0.0 110.704 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -71.38 140.08 50.02 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.097 -1.002 . . . . 0.0 110.687 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.43 161.37 21.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.551 -0.718 . . . . 0.0 110.371 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 1.081 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.14 -34.03 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.733 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -60.61 -37.76 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -0.941 . . . . 0.0 109.339 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -31.24 68.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.445 -0.784 . . . . 0.0 109.425 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 88.3 t -70.28 -42.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.411 -0.806 . . . . 0.0 109.38 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.501 ' HE3' HG22 ' B' ' 23' ' ' ILE . 34.8 mttt -63.0 -41.77 99.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.474 -0.766 . . . . 0.0 109.251 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -35.22 76.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.446 -0.784 . . . . 0.0 109.282 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.546 ' CD ' HG12 ' B' ' 17' ' ' VAL . 8.4 mttm -68.3 -38.18 81.37 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 109.661 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.6 mt -67.3 -40.31 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.103 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.52 -49.63 76.79 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.449 -0.782 . . . . 0.0 109.462 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.12 -26.53 62.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.326 -0.859 . . . . 0.0 110.314 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -83.91 -41.24 17.62 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.406 -0.809 . . . . 0.0 110.739 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.06 -56.1 2.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.264 -0.898 . . . . 0.0 110.417 -179.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.57 19.57 1.65 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.504 HG23 ' HD2' ' B' ' 37' ' ' PRO . 22.6 mt -91.31 143.89 28.95 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.061 -1.258 . . . . 0.0 109.644 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.504 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.3 Cg_endo -68.2 133.64 29.18 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.614 1.323 . . . . 0.0 110.482 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.77 -23.81 77.35 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.79 1.416 . . . . 0.0 110.991 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.82 -23.77 64.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.252 -0.905 . . . . 0.0 109.762 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.503 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.38 0.63 40.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.428 -0.795 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -94.22 137.61 33.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.198 -0.939 . . . . 0.0 110.407 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -130.12 132.01 45.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 1.081 HD12 HG23 ' B' ' 23' ' ' ILE . 39.2 mt -104.79 118.03 35.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.398 -0.814 . . . . 0.0 110.673 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.78 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.33 133.41 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.5 -0.75 . . . . 0.0 109.797 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 11.4 t80 -141.25 155.54 46.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.397 -0.814 . . . . 0.0 109.977 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.426 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 44.7 24.75 0.11 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.424 -0.797 . . . . 0.0 111.558 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.8 -8.86 67.56 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.119 -1.039 . . . . 0.0 110.851 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' B' ' 45' ' ' PHE . 9.2 ptmt -110.69 142.14 43.0 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.809 -1.406 . . . . 0.0 110.484 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.4 137.26 37.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.346 -0.846 . . . . 0.0 109.908 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.797 HD22 ' CG ' ' B' ' 59' ' ' TYR . 24.9 mt -83.79 148.84 26.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.333 -0.854 . . . . 0.0 110.346 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -93.48 130.25 39.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.298 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.56 -28.13 3.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.494 -0.754 . . . . 0.0 111.079 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 -3.05 90.66 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.405 ' O ' HD13 ' B' ' 23' ' ' ILE . 12.2 mmt180 -99.49 155.99 17.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.126 -1.22 . . . . 0.0 110.346 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.55 163.19 12.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.388 -0.82 . . . . 0.0 110.182 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.581 ' HA ' HD12 ' B' ' 61' ' ' ILE . 85.9 mt -53.24 -45.74 68.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.281 -0.887 . . . . 0.0 110.574 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.5 t -56.93 -35.89 69.58 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.415 -0.803 . . . . 0.0 110.838 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -59.6 -29.43 67.97 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.307 -0.871 . . . . 0.0 110.44 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.797 ' CG ' HD22 ' B' ' 50' ' ' LEU . 41.8 m-85 -101.07 28.48 5.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.352 -0.843 . . . . 0.0 109.977 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 26.2 m-20 50.7 28.23 3.45 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.512 -0.743 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.702 HD13 HD21 ' B' ' 67' ' ' LEU . 88.0 mt -81.47 110.19 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.394 -0.816 . . . . 0.0 109.876 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -105.62 172.48 6.77 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.282 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.3 pttt -46.62 151.97 0.52 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.477 -0.765 . . . . 0.0 110.995 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 4.0 mm-40 62.76 15.94 8.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.783 -0.573 . . . . 0.0 110.623 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.61 145.23 49.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.929 . . . . 0.0 110.162 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 39.8 m -107.76 109.78 21.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.842 . . . . 0.0 110.082 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.702 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.29 161.58 13.58 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.345 -0.847 . . . . 0.0 110.043 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -108.64 132.01 54.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 109.909 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.595 HD23 HG22 ' B' ' 7' ' ' THR . 32.9 tp -107.05 136.09 47.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.318 -0.864 . . . . 0.0 110.165 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.862 . . . . 0.0 109.953 179.969 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.25 0.548 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.31 -30.13 57.6 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.222 -0.924 . . . . 0.0 109.119 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.883 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mp -64.99 -29.06 69.96 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 tt -76.44 -37.57 56.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 0.0 109.769 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.435 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.8 OUTLIER -83.51 -55.84 4.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.297 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.2 tpt -52.12 -45.35 64.91 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.203 -0.936 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.0 m -66.22 -42.64 88.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.343 -0.848 . . . . 0.0 110.474 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.435 HG22 ' HA ' ' A' ' 68' ' ' LYS . 4.5 tp -82.78 -6.39 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 0.0 110.368 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -82.26 -46.68 13.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 110.044 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -83.74 -20.88 32.6 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.362 -0.836 . . . . 0.0 110.433 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.465 -179.812 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 74.7 p . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.419 0.628 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.527 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.0 pt-20 -68.61 -28.85 67.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.582 -0.699 . . . . 0.0 109.279 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.437 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 33.6 mt-10 -85.61 -40.68 15.97 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 179.03 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -64.85 -43.71 92.13 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -66.74 -34.12 77.13 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.527 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.41 -35.75 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -38.44 91.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.486 -0.759 . . . . 0.0 109.485 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.68 -42.54 64.17 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.94 92.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.46 -0.775 . . . . 0.0 110.018 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 34.6 mmm -75.53 -22.41 57.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.419 -0.801 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.482 0 O-C-N 121.545 -0.722 . . . . 0.0 109.902 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.204 0.526 . . . . 0.0 110.35 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.67 134.42 47.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.409 -0.807 . . . . 0.0 109.555 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 13.2 pt -136.9 155.6 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 109.943 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -111.64 144.28 41.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.559 -0.713 . . . . 0.0 111.04 -179.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.2 t -127.82 117.77 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.476 -0.765 . . . . 0.0 109.262 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.29 133.95 43.95 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.507 -0.746 . . . . 0.0 110.894 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 72.1 p -96.4 172.08 8.17 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 39.7 mt -61.7 -11.58 12.57 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.405 -0.809 . . . . 0.0 111.017 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.4 p -95.61 0.22 52.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.015 -1.053 . . . . 0.0 110.909 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.46 9.11 67.26 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.5 tttp -84.61 126.09 33.04 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.089 -1.242 . . . . 0.0 109.859 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.0 m -112.97 123.39 50.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.303 -0.873 . . . . 0.0 110.284 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.404 HD13 HG21 ' B' ' 13' ' ' ILE . 17.9 mt -109.23 136.58 44.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.534 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.5 m -102.25 119.47 38.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.432 -0.792 . . . . 0.0 109.377 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.69 162.42 23.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.149 -0.969 . . . . 0.0 111.023 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.438 ' HA ' ' O ' ' B' ' 1' ' ' MET . 3.4 mm-40 -106.32 118.89 37.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.542 -0.724 . . . . 0.0 109.262 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.4 m -140.4 178.65 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.157 -0.964 . . . . 0.0 111.333 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.489 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.2 mm-40 -113.57 159.8 34.1 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -73.69 -24.95 15.25 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 O-C-N 123.403 1.212 . . . . 0.0 110.041 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.8 -4.62 59.15 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.241 -0.912 . . . . 0.0 110.328 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -71.14 144.99 50.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.176 -0.952 . . . . 0.0 110.573 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 71.8 p -83.25 158.24 22.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.484 -0.76 . . . . 0.0 110.329 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.525 ' CG2' HD12 ' B' ' 43' ' ' LEU . 46.0 mm -59.75 -32.31 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.841 . . . . 0.0 109.505 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.73 -36.96 84.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.421 -0.799 . . . . 0.0 109.251 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.3 -32.01 69.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.506 -0.746 . . . . 0.0 109.162 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' VAL . . . . . 0.427 HG21 HD21 ' B' ' 56' ' ' LEU . 58.4 t -70.13 -41.18 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.466 -0.771 . . . . 0.0 109.223 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -62.96 -41.64 99.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 109.151 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.57 -34.4 75.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.744 . . . . 0.0 109.422 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -68.03 -39.01 83.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.459 179.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.0 mt -66.94 -38.73 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.315 -0.866 . . . . 0.0 109.098 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -49.56 77.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.448 -0.782 . . . . 0.0 109.457 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.24 -27.21 63.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.516 -0.74 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.82 -40.94 18.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.252 -0.905 . . . . 0.0 110.875 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -108.04 -55.78 2.32 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.253 -0.904 . . . . 0.0 110.419 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.08 18.72 1.66 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.483 HG23 ' HD2' ' B' ' 37' ' ' PRO . 80.8 mt -91.38 143.12 27.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.13 -1.217 . . . . 0.0 109.944 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.483 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.8 Cg_endo -69.98 133.73 25.85 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 O-C-N 123.542 1.285 . . . . 0.0 110.492 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.81 -26.69 83.52 Favored 'Trans proline' 0 C--N 1.313 -1.321 0 O-C-N 123.618 1.325 . . . . 0.0 110.949 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.76 -24.25 64.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.357 -0.839 . . . . 0.0 109.968 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.432 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 28.8 mm-40 -101.43 0.59 37.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.288 -0.882 . . . . 0.0 110.441 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -94.38 140.25 30.05 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.14 -0.975 . . . . 0.0 110.447 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -130.14 128.43 41.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.453 -0.779 . . . . 0.0 109.797 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.905 ' HB3' HD12 ' B' ' 50' ' ' LEU . 32.5 mt -104.68 118.97 37.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.322 -0.861 . . . . 0.0 110.522 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.653 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.6 mp -121.36 135.98 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.506 -0.746 . . . . 0.0 109.922 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -140.83 151.2 44.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.468 -0.77 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.37 28.27 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.511 -0.743 . . . . 0.0 111.195 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.54 1.44 76.64 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.01 137.67 48.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.07 -1.253 . . . . 0.0 110.175 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -78.33 139.13 38.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.258 -0.902 . . . . 0.0 109.998 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.905 HD12 ' HB3' ' B' ' 43' ' ' LEU . 55.1 mt -83.89 143.45 29.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.333 -0.855 . . . . 0.0 110.348 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.62 126.52 38.83 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.505 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.463 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.8 p30 -48.69 -29.73 4.75 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.444 -0.785 . . . . 0.0 111.132 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -6.15 88.69 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -99.47 158.6 15.62 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.025 -1.279 . . . . 0.0 110.388 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.5 p -102.06 164.12 11.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.438 -0.789 . . . . 0.0 110.288 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.61 ' HA ' HD12 ' B' ' 61' ' ' ILE . 92.9 mt -53.86 -45.7 71.04 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.341 -0.849 . . . . 0.0 110.751 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 55.4 p -56.58 -34.17 66.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.303 -0.873 . . . . 0.0 111.198 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -59.52 -27.65 66.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.094 -1.004 . . . . 0.0 110.374 -179.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.475 ' CG ' HD22 ' B' ' 50' ' ' LEU . 70.5 m-85 -101.12 27.02 6.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.857 . . . . 0.0 109.983 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.92 32.35 7.28 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.61 HD12 ' HA ' ' B' ' 56' ' ' LEU . 97.7 mt -81.56 108.91 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.286 -0.884 . . . . 0.0 109.869 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -105.64 173.67 6.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.374 -0.829 . . . . 0.0 110.346 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.4 ptmt -46.62 152.1 0.5 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.59 -0.694 . . . . 0.0 111.17 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.3 mm-40 62.84 15.47 8.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.792 -0.568 . . . . 0.0 110.841 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.64 139.17 49.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -107.37 111.05 23.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.927 . . . . 0.0 110.03 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.444 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mp -102.29 164.0 11.92 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.28 -0.888 . . . . 0.0 110.022 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -108.88 130.7 55.43 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 109.996 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 tp -107.19 133.67 51.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.883 . . . . 0.0 110.286 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 27.7 t . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.405 -0.809 . . . . 0.0 109.958 179.805 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.27 0.557 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -74.6 -28.13 60.77 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.183 -0.948 . . . . 0.0 109.161 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.93 97.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.931 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.29 -29.2 69.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.1 tt -75.17 -43.46 52.1 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.482 -0.762 . . . . 0.0 109.891 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.423 -0.798 . . . . 0.0 110.482 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -39.87 61.48 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.144 -0.972 . . . . 0.0 110.671 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.7 m -69.43 -41.31 76.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.299 -0.876 . . . . 0.0 110.453 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.2 tp -82.18 -16.4 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.114 -0.991 . . . . 0.0 110.134 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -74.61 -33.74 62.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.3 -0.875 . . . . 0.0 109.748 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -27.71 23.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.469 -0.77 . . . . 0.0 109.93 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.338 -0.851 . . . . 0.0 110.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.1 p . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.336 0.588 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.572 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.9 pt-20 -67.14 -31.29 71.63 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.543 -0.723 . . . . 0.0 109.175 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.455 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.9 OUTLIER -85.48 -40.75 16.03 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.989 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -42.56 99.75 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -69.8 -35.92 75.24 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 178.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.572 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.76 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.798 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.67 72.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.541 -0.724 . . . . 0.0 109.802 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.21 -52.7 7.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.481 -0.762 . . . . 0.0 110.09 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.0 -33.09 74.94 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.4 -0.812 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.2 ttm -80.2 -21.52 42.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 109.824 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.422 -0.799 . . . . 0.0 110.071 179.878 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.26 0.552 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 2' ' ' GLN . . . . . 0.443 ' HG2' HG22 ' B' ' 14' ' ' THR . 0.4 OUTLIER -97.24 145.38 26.12 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.502 -0.749 . . . . 0.0 109.903 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 12.7 pt -137.65 159.47 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.344 -0.848 . . . . 0.0 110.17 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -111.85 142.82 43.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.582 -0.699 . . . . 0.0 110.754 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -127.76 118.16 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.476 -0.765 . . . . 0.0 109.503 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 30.2 mttt -100.25 135.19 42.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 110.607 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -96.04 170.04 9.56 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.454 -0.779 . . . . 0.0 110.189 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.693 HD11 HG13 ' B' ' 70' ' ' VAL . 8.3 mt -61.82 -9.27 6.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.459 -0.776 . . . . 0.0 111.203 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.9 p -95.27 -13.34 24.94 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.081 -1.012 . . . . 0.0 110.564 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 6.16 40.26 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.238 -1.145 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 56.7 tttt -84.61 128.56 34.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.113 -1.228 . . . . 0.0 110.049 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.8 m -113.23 125.21 54.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.303 -0.873 . . . . 0.0 110.08 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.4 mt -109.12 135.13 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.439 -0.788 . . . . 0.0 110.522 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.443 HG22 ' HG2' ' B' ' 2' ' ' GLN . 3.1 m -102.43 118.0 35.93 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.516 -0.74 . . . . 0.0 109.26 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -123.38 166.45 15.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.156 -0.965 . . . . 0.0 110.821 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.5 115.11 29.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.441 -0.787 . . . . 0.0 109.528 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.441 HG12 ' CD ' ' B' ' 29' ' ' LYS . 21.5 m -140.51 170.26 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.282 -0.886 . . . . 0.0 110.823 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -112.7 164.62 14.95 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.586 -0.696 . . . . 0.0 109.185 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -70.94 -25.51 23.04 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.569 1.3 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.36 -3.93 58.58 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.444 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -71.31 143.6 50.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.559 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.6 p -83.21 156.66 23.06 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.547 -0.72 . . . . 0.0 110.446 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 31.4 mm -59.67 -34.77 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.383 -0.823 . . . . 0.0 109.616 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.74 -36.92 82.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.34 -0.85 . . . . 0.0 109.33 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.2 -32.21 70.02 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.353 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.36 -39.2 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.451 -0.78 . . . . 0.0 109.049 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -63.14 -43.78 97.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.103 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.05 73.13 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.463 -0.773 . . . . 0.0 109.469 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.441 ' CD ' HG12 ' B' ' 17' ' ' VAL . 19.6 mttm -68.07 -40.26 82.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.495 -0.753 . . . . 0.0 109.543 179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.423 HD13 HD22 ' B' ' 69' ' ' LEU . 18.0 mt -67.1 -37.14 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.586 -0.845 . . . . 0.0 109.03 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -60.83 -52.72 63.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.474 -0.767 . . . . 0.0 109.644 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -27.46 63.7 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.712 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -84.0 -39.93 19.07 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.198 -0.939 . . . . 0.0 111.037 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -108.15 -54.19 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.278 -0.889 . . . . 0.0 110.512 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.81 16.64 2.19 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.264 -1.135 . . . . 0.0 110.264 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.495 HG23 ' HD2' ' B' ' 37' ' ' PRO . 93.5 mt -91.2 143.51 28.48 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.077 -1.249 . . . . 0.0 109.778 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.495 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -69.49 133.88 27.17 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.66 1.347 . . . . 0.0 110.556 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.83 -26.43 83.05 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.741 1.39 . . . . 0.0 110.81 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.78 -25.65 64.81 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.341 -0.85 . . . . 0.0 109.902 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.448 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 58.8 mm-40 -101.26 4.36 41.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.35 -0.844 . . . . 0.0 110.464 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.22 139.32 31.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.238 -0.914 . . . . 0.0 110.468 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -130.17 126.4 37.35 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.473 -0.767 . . . . 0.0 109.783 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.769 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.7 mt -104.64 117.91 35.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.251 -0.905 . . . . 0.0 110.376 -179.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.769 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.35 138.06 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.513 -0.742 . . . . 0.0 109.92 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.56 ' HB2' HD23 ' B' ' 67' ' ' LEU . 66.8 t80 -140.7 147.88 39.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.567 -0.708 . . . . 0.0 109.753 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 28.8 0.51 Allowed 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.416 -0.803 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.8 3.75 87.69 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.85 133.69 53.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.083 -1.245 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -78.49 134.3 37.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.064 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.881 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.9 mt -84.27 140.31 31.74 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.385 -0.822 . . . . 0.0 110.28 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -93.67 130.49 39.59 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.406 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.502 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.2 m-20 -48.43 -26.75 2.25 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.433 -0.792 . . . . 0.0 111.202 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.96 -8.05 86.33 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.702 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.479 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.34 159.04 15.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.01 -1.288 . . . . 0.0 110.432 -179.708 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.1 p -102.08 162.98 12.49 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.396 -0.815 . . . . 0.0 110.182 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.414 ' HA ' HD12 ' B' ' 61' ' ' ILE . 82.0 mt -53.45 -43.98 68.53 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.295 -0.878 . . . . 0.0 110.669 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.9 -34.72 68.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.413 -0.804 . . . . 0.0 111.131 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.5 -26.96 65.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.11 -0.994 . . . . 0.0 110.394 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.881 ' CD2' HD22 ' B' ' 50' ' ' LEU . 53.2 m-85 -101.15 26.21 7.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 110.053 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m120 50.63 31.06 5.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.541 -0.724 . . . . 0.0 110.728 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.5 mt -81.41 114.53 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.86 . . . . 0.0 109.784 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -105.55 167.86 9.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.384 -0.823 . . . . 0.0 110.219 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.9 pttt -46.54 153.13 0.39 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.479 -0.763 . . . . 0.0 111.041 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 21.0 mt-10 63.4 14.01 7.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.766 -0.584 . . . . 0.0 110.818 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.83 144.62 49.05 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.157 -0.964 . . . . 0.0 110.225 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.0 m -107.51 110.9 22.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.331 -0.856 . . . . 0.0 109.818 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.56 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.7 mt -102.38 165.03 11.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.252 -0.905 . . . . 0.0 110.344 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -108.82 129.53 55.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.358 -0.839 . . . . 0.0 110.125 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.423 HD22 HD13 ' B' ' 30' ' ' ILE . 60.3 tp -107.34 131.24 54.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.693 HG13 HD11 ' B' ' 8' ' ' LEU . 47.1 t . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.423 -0.798 . . . . 0.0 110.18 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.5 t0 . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.173 0.511 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.18 -28.89 61.51 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.243 -0.91 . . . . 0.0 109.075 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.47 96.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.939 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.4 tp -65.08 -28.35 69.4 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.568 ' C ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -73.45 -48.35 34.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.535 -0.728 . . . . 0.0 109.563 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.63 -52.95 7.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 110.545 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 tpt -51.73 -38.78 56.77 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.232 -0.917 . . . . 0.0 110.824 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.3 m -71.11 -40.65 71.33 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.264 -0.898 . . . . 0.0 110.396 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 tp -83.65 -13.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.973 . . . . 0.0 110.226 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -76.28 -48.43 20.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.293 -0.88 . . . . 0.0 109.784 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -25.41 47.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 110.064 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.831 . . . . 0.0 110.223 -179.964 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 75.4 p . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.364 0.602 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.545 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -67.24 -31.83 72.44 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.477 -0.764 . . . . 0.0 109.248 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 27.3 mt-10 -85.44 -40.61 16.22 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -63.89 -42.26 97.52 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.1 -35.39 76.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.545 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.31 -36.83 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.87 -29.76 69.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 109.616 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -83.82 -38.51 21.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.466 -0.772 . . . . 0.0 110.057 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -79.57 -28.98 41.12 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.329 -0.857 . . . . 0.0 110.469 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -83.96 -31.83 25.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.3 -0.875 . . . . 0.0 109.73 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.505 -0.747 . . . . 0.0 110.008 179.844 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.4 ttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.303 0.573 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -112.96 140.19 47.97 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.374 -0.829 . . . . 0.0 109.606 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.504 HD13 HG21 ' B' ' 17' ' ' VAL . 43.2 pt -137.72 157.15 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.212 -0.93 . . . . 0.0 110.535 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -111.89 144.89 40.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.598 -0.689 . . . . 0.0 110.546 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 68.4 t -128.13 122.38 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.342 -0.849 . . . . 0.0 109.603 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.469 ' HG3' HG23 ' B' ' 12' ' ' THR . 12.0 mttt -100.16 131.98 45.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.689 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.4 p -95.79 175.71 6.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.431 -0.793 . . . . 0.0 109.921 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 22.1 mt -61.57 -12.77 16.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.309 -0.869 . . . . 0.0 111.17 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.2 p -95.73 14.5 22.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.007 -1.058 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.84 8.34 68.1 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.432 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 24.5 tttt -84.79 134.02 34.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.066 -1.256 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.469 HG23 ' HG3' ' B' ' 6' ' ' LYS . 5.3 m -113.26 130.28 56.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -0.881 . . . . 0.0 110.318 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 mt -109.15 141.89 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.401 -0.812 . . . . 0.0 110.239 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 8.5 m -101.84 121.94 43.05 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.441 -0.787 . . . . 0.0 109.504 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.443 HD23 ' HE2' ' B' ' 33' ' ' LYS . 4.6 mt -123.27 156.27 35.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.16 -0.963 . . . . 0.0 110.831 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 113.95 27.79 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.422 -0.798 . . . . 0.0 109.422 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.691 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.2 m -139.9 178.46 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.309 -0.869 . . . . 0.0 110.856 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.609 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -113.01 166.14 11.7 Favored Pre-proline 0 N--CA 1.489 1.492 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.662 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.27 -28.86 14.81 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.469 1.247 . . . . 0.0 110.277 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.44 -0.68 53.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.63 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -71.21 142.71 50.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.38 159.51 21.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.537 -0.727 . . . . 0.0 110.498 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.861 HG23 HD12 ' B' ' 43' ' ' LEU . 44.1 mm -59.71 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.363 -0.836 . . . . 0.0 109.565 179.43 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -36.88 74.74 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.385 -0.822 . . . . 0.0 109.425 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -70.06 -31.17 68.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.495 -0.753 . . . . 0.0 109.208 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 22' ' ' THR . 58.2 t -70.24 -39.89 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 119.839 -0.745 . . . . 0.0 109.134 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -63.26 -43.05 99.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.502 -0.749 . . . . 0.0 109.178 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.9 76.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.502 -0.749 . . . . 0.0 109.49 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.691 ' CD ' HG12 ' B' ' 17' ' ' VAL . 30.4 mttm -68.12 -38.32 82.09 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.501 -0.749 . . . . 0.0 109.491 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.19 -39.73 83.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.415 -0.803 . . . . 0.0 109.111 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' B' ' 35' ' ' GLY . 13.9 tt0 -60.61 -47.86 84.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.301 -0.875 . . . . 0.0 109.299 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -58.01 -27.76 63.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.407 -0.808 . . . . 0.0 110.241 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.443 ' HE2' HD23 ' B' ' 15' ' ' LEU . 2.9 mmtm -84.27 -41.26 17.06 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.399 -0.813 . . . . 0.0 110.874 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -107.76 -55.79 2.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.248 -0.907 . . . . 0.0 110.365 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.8 21.27 1.77 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.524 HG23 ' HD2' ' B' ' 37' ' ' PRO . 56.8 mt -91.65 144.4 29.44 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.197 -1.178 . . . . 0.0 109.976 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.524 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -68.51 131.83 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.536 1.282 . . . . 0.0 110.622 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.96 -24.61 79.87 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.653 1.344 . . . . 0.0 110.714 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.61 -25.4 64.84 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.829 . . . . 0.0 109.731 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.429 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 4.4 mt-30 -101.33 0.1 36.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.49 -0.756 . . . . 0.0 110.425 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -94.44 137.22 33.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.201 -0.937 . . . . 0.0 110.475 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.22 134.69 47.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.454 -0.779 . . . . 0.0 109.765 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.861 HD12 HG23 ' B' ' 23' ' ' ILE . 18.0 mt -104.67 116.59 32.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.217 -0.927 . . . . 0.0 110.333 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.788 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.2 mp -121.21 135.14 62.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.463 -0.773 . . . . 0.0 109.831 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.526 ' HB2' HD23 ' B' ' 67' ' ' LEU . 25.8 t80 -140.69 145.98 37.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.338 -0.851 . . . . 0.0 109.767 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.66 28.93 0.59 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.741 . . . . 0.0 110.932 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.56 5.1 88.02 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -111.03 128.71 55.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.166 -1.197 . . . . 0.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 132.48 37.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 109.589 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.845 HD22 ' CD2' ' B' ' 59' ' ' TYR . 48.9 mt -83.74 142.96 30.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.223 -0.923 . . . . 0.0 110.274 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -93.5 133.12 37.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.486 -0.759 . . . . 0.0 110.442 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.478 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 65.9 m-20 -48.54 -28.18 3.22 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.565 -0.709 . . . . 0.0 111.027 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -5.85 88.81 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 120.116 -1.04 . . . . 0.0 110.692 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.455 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 11.2 mmt180 -99.51 153.57 18.92 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.027 -1.278 . . . . 0.0 110.488 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.6 p -102.23 165.63 11.03 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.291 -0.881 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.609 HD12 ' O ' ' B' ' 18' ' ' GLU . 87.8 mt -53.6 -45.66 70.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.29 -0.881 . . . . 0.0 110.78 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -56.82 -38.39 72.54 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.432 -0.792 . . . . 0.0 110.958 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -59.68 -27.93 66.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.325 -0.86 . . . . 0.0 110.425 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.845 ' CD2' HD22 ' B' ' 50' ' ' LEU . 40.8 m-85 -100.98 26.72 6.67 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.954 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 50.69 27.39 2.97 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.569 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.565 HG21 HD22 ' B' ' 56' ' ' LEU . 88.0 mt -81.37 109.46 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.377 -0.827 . . . . 0.0 109.79 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.54 172.11 6.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.426 -0.796 . . . . 0.0 110.164 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.44 152.73 0.42 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.547 -0.721 . . . . 0.0 111.084 -179.841 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.7 mm-40 63.0 16.55 9.37 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.81 -0.556 . . . . 0.0 110.595 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.63 145.66 48.82 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.3 m -107.91 108.05 19.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.526 HD23 ' HB2' ' B' ' 45' ' ' PHE . 10.3 mt -102.54 157.96 16.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.29 -0.881 . . . . 0.0 110.091 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -108.88 138.52 45.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.254 -0.904 . . . . 0.0 109.995 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 45.9 tp -106.95 133.16 52.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.349 -0.845 . . . . 0.0 110.276 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 110.405 -179.817 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 121.137 0.494 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -75.1 -28.92 60.45 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.246 -0.909 . . . . 0.0 109.145 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.92 97.66 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.685 -0.806 . . . . 0.0 108.869 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -28.62 69.44 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -75.69 -45.78 34.95 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.598 -0.688 . . . . 0.0 109.869 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.447 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.01 -53.51 6.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.484 -0.76 . . . . 0.0 110.487 -179.851 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.92 -40.37 60.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.139 -0.976 . . . . 0.0 110.643 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.2 m -69.43 -41.17 76.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.259 -0.9 . . . . 0.0 110.423 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.447 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.0 tp -85.38 -10.62 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.076 -1.015 . . . . 0.0 110.466 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 30.3 t -80.32 -36.27 34.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.717 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -89.25 -23.87 22.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.54 -0.725 . . . . 0.0 110.067 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.344 -0.847 . . . . 0.0 110.461 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.492 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.7 p . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.3 0.571 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.543 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.9 pt-20 -69.49 -29.45 67.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.511 -0.743 . . . . 0.0 109.365 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.437 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.7 OUTLIER -84.7 -38.41 19.77 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.492 ' HB2' ' N ' ' A' ' 88' ' ' THR . 10.0 mm-40 -66.52 -43.77 84.29 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -66.6 -35.39 80.09 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.543 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.8 -35.74 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.703 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.2 -38.84 92.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.622 -0.674 . . . . 0.0 109.402 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -44.89 59.23 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.508 -0.745 . . . . 0.0 109.95 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.77 82.16 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.414 -0.804 . . . . 0.0 110.019 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 20.5 mmt -79.32 -24.64 42.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.31 -0.869 . . . . 0.0 109.628 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 0.0 109.991 179.837 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.461 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.4 ttp . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.241 0.543 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -88.09 140.78 29.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.0 109.717 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.492 HD13 HG21 ' B' ' 17' ' ' VAL . 35.3 pt -137.37 157.65 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.257 -0.902 . . . . 0.0 110.259 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.8 144.31 41.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.654 -0.654 . . . . 0.0 110.598 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 12' ' ' THR . 61.3 t -128.16 126.02 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 109.659 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.43 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -99.81 138.45 36.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.285 -0.885 . . . . 0.0 110.636 -179.501 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 74.2 p -95.85 171.56 8.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.479 -0.763 . . . . 0.0 110.481 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.34 -14.05 24.16 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -0.813 . . . . 0.0 111.164 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.2 p -95.6 -23.6 16.97 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.092 -1.005 . . . . 0.0 110.75 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.59 10.94 8.98 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.3 ttpm? -84.57 137.42 33.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.268 . . . . 0.0 109.797 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 10.0 m -113.12 126.31 55.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.291 -0.881 . . . . 0.0 110.306 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 mt -108.96 136.3 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.411 -0.806 . . . . 0.0 110.255 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.4 m -101.85 121.09 41.45 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 109.319 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mt -123.3 159.37 28.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.192 -0.943 . . . . 0.0 110.858 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -106.35 113.71 27.39 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.183 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.655 HG12 ' HD2' ' B' ' 29' ' ' LYS . 33.8 m -140.19 174.34 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.331 -0.856 . . . . 0.0 110.951 -178.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.618 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.4 OUTLIER -112.9 165.41 13.19 Favored Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.637 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.92 -26.97 18.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.525 1.276 . . . . 0.0 110.326 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.39 -2.63 57.46 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 110.522 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.58 142.28 50.03 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 65.8 p -83.41 160.5 21.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.704 . . . . 0.0 110.485 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.674 HG23 HD12 ' B' ' 43' ' ' LEU . 42.0 mm -59.64 -35.64 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.619 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.86 -35.88 75.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.197 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -32.21 69.53 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.536 -0.728 . . . . 0.0 109.29 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 72.4 t -69.96 -42.84 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.499 -0.751 . . . . 0.0 109.387 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -62.88 -40.69 98.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.466 -0.771 . . . . 0.0 109.324 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -36.46 81.03 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.682 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.655 ' HD2' HG12 ' B' ' 17' ' ' VAL . 40.4 mttp -68.15 -38.12 81.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 0.0 109.688 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mt -67.02 -39.59 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.374 -0.829 . . . . 0.0 109.119 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.2 tm0? -60.48 -48.89 79.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.429 -0.794 . . . . 0.0 109.422 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.08 -26.55 62.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.787 . . . . 0.0 110.25 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -84.07 -39.97 18.9 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -108.03 -55.97 2.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.316 -0.865 . . . . 0.0 110.622 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.02 15.7 2.29 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.519 HG23 ' HD2' ' B' ' 37' ' ' PRO . 60.7 mt -91.38 144.62 29.99 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.134 -1.215 . . . . 0.0 109.849 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.519 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -69.77 134.64 28.45 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.546 1.287 . . . . 0.0 110.454 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -61.02 -26.59 83.34 Favored 'Trans proline' 0 C--N 1.312 -1.376 0 O-C-N 123.793 1.417 . . . . 0.0 111.152 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.92 -19.67 64.2 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.26 -0.9 . . . . 0.0 110.228 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.465 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.4 mp0 -100.98 -9.42 21.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 110.753 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' GLN . . . . . 0.416 ' HB3' HD11 ' B' ' 69' ' ' LEU . 19.2 mt-30 -94.35 145.7 24.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.166 -0.959 . . . . 0.0 110.873 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.463 ' HG2' HD11 ' B' ' 44' ' ' ILE . 3.6 ttt85 -130.18 134.25 47.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.514 -0.742 . . . . 0.0 109.522 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.786 ' C ' HD12 ' B' ' 44' ' ' ILE . 25.8 mt -104.34 117.54 34.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.423 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.786 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.1 mp -121.2 133.68 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.633 -0.667 . . . . 0.0 109.742 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.419 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 28.4 t80 -140.63 151.44 44.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.454 -0.779 . . . . 0.0 109.902 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.419 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.42 27.41 0.37 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.491 -0.756 . . . . 0.0 111.243 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.81 -0.82 81.16 Favored Glycine 0 N--CA 1.495 2.594 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.605 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.87 136.0 50.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.069 -1.254 . . . . 0.0 110.275 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.5 137.06 37.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.88 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.711 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.5 mt -84.1 139.9 32.16 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.0 110.324 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -93.61 134.71 35.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.306 -0.871 . . . . 0.0 110.465 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.454 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.7 p-10 -48.6 -30.89 5.84 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.495 -0.753 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.01 -4.02 90.18 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 23.6 mmt180 -99.63 153.54 18.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.053 -1.263 . . . . 0.0 110.652 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 78.4 p -102.33 163.42 12.24 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.333 -0.854 . . . . 0.0 110.222 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.618 HD12 ' O ' ' B' ' 18' ' ' GLU . 71.9 mt -53.52 -43.87 68.68 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.223 -0.923 . . . . 0.0 110.616 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 85.8 p -56.67 -37.33 70.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.389 -0.819 . . . . 0.0 111.051 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.44 -26.46 65.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.185 -0.947 . . . . 0.0 110.354 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.711 ' CD2' HD22 ' B' ' 50' ' ' LEU . 70.0 m-85 -101.24 25.11 8.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.177 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t30 50.52 29.21 3.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.477 -0.764 . . . . 0.0 110.726 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.662 HD13 HD21 ' B' ' 67' ' ' LEU . 94.1 mt -81.39 112.45 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 109.759 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -105.57 170.77 7.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.373 -0.829 . . . . 0.0 110.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.0 OUTLIER -46.53 151.89 0.51 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.56 -0.713 . . . . 0.0 111.04 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 52.2 mm-40 62.86 16.44 9.11 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.714 -0.616 . . . . 0.0 110.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 147.7 47.22 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.907 . . . . 0.0 110.205 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -107.66 109.22 20.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.374 -0.828 . . . . 0.0 109.878 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.662 HD21 HD13 ' B' ' 61' ' ' ILE . 1.3 mt -102.23 158.85 15.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.322 -0.862 . . . . 0.0 110.019 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -108.77 131.98 54.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.86 . . . . 0.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.416 HD11 ' HB3' ' B' ' 41' ' ' GLN . 31.0 tp -107.19 136.08 47.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.35 -0.844 . . . . 0.0 110.009 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 121.271 -0.893 . . . . 0.0 110.222 -179.893 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.46 -178.66 3.43 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.336 -0.852 . . . . 0.0 110.169 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 mp -112.41 25.74 11.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.533 -0.729 . . . . 0.0 109.485 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.87 -40.28 7.7 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt 52.22 83.02 0.06 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.31 -1.112 . . . . 0.0 110.478 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.99 78.44 0.61 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -130.0 -63.48 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.405 -1.056 . . . . 0.0 110.248 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.05 28.68 4.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.374 -0.829 . . . . 0.0 110.222 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.46 -24.84 19.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.446 -0.784 . . . . 0.0 110.186 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -90.37 -28.32 18.77 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.296 -0.878 . . . . 0.0 110.297 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.22 34.01 3.08 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 110.312 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.17 -42.18 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.363 -0.836 . . . . 0.0 110.098 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.38 -24.45 75.0 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.624 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 35.2 m -125.69 -38.77 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.209 -1.171 . . . . 0.0 110.407 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.453 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.1 OUTLIER 57.44 176.93 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.207 -0.933 . . . . 0.0 109.807 -179.854 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 42.6 Cg_endo -69.29 -20.99 36.3 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.545 1.287 . . . . 0.0 110.4 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.3 t -72.3 -13.1 61.41 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.322 -0.861 . . . . 0.0 110.388 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.624 ' HB2' ' O ' ' A' ' 14' ' ' VAL . . . -83.74 -25.65 30.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.176 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.44 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 33.9 p-10 -165.28 116.31 0.87 Allowed Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.338 -0.851 . . . . 0.0 110.383 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.12 -14.75 35.3 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 O-C-N 123.998 1.525 . . . . 0.0 109.875 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.39 -29.83 66.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.438 -0.789 . . . . 0.0 109.123 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.428 HD13 ' OD2' ' A' ' 19' ' ' ASP . 0.1 OUTLIER -89.18 -32.09 17.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.604 -0.685 . . . . 0.0 109.285 179.199 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.78 -32.48 59.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.0 109.535 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.605 ' O ' HG23 ' A' ' 28' ' ' VAL . 37.7 tp -79.91 -37.25 35.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.426 -0.797 . . . . 0.0 109.843 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.17 -36.36 83.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.371 -0.831 . . . . 0.0 109.911 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.466 HD23 ' O ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -80.75 -21.3 41.21 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.426 -0.796 . . . . 0.0 110.31 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -80.27 -28.0 38.45 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.304 -0.873 . . . . 0.0 109.303 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 24' ' ' LEU . 83.2 t -81.28 -32.86 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.623 -0.673 . . . . 0.0 109.629 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.19 -41.52 49.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.394 -0.816 . . . . 0.0 110.038 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.0 mmm -66.08 -37.45 85.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.347 -0.846 . . . . 0.0 109.985 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.48 -42.49 92.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.317 -0.864 . . . . 0.0 110.031 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -61.23 -34.03 74.46 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.427 -0.796 . . . . 0.0 110.146 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -72.7 -39.15 67.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.362 -0.836 . . . . 0.0 110.132 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -48.43 78.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.257 -0.902 . . . . 0.0 109.769 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -29.96 66.7 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.434 -0.791 . . . . 0.0 109.754 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -82.95 -38.03 23.32 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.442 -0.786 . . . . 0.0 109.815 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.596 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -62.31 -37.57 86.09 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.442 -0.786 . . . . 0.0 109.946 179.796 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.4 -57.25 3.97 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.491 -0.756 . . . . 0.0 109.5 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.73 -30.56 33.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.483 -0.761 . . . . 0.0 109.304 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -88.07 -33.19 18.39 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.59 -0.694 . . . . 0.0 109.207 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.1 -46.62 83.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.371 -0.831 . . . . 0.0 109.582 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 12.9 ptt85 -73.0 -32.67 65.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.414 -0.804 . . . . 0.0 109.8 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -37.17 63.77 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.397 -0.815 . . . . 0.0 109.317 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.82 -28.85 44.5 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 42' ' ' ARG . . . -60.04 -28.17 67.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.585 -0.697 . . . . 0.0 109.675 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -93.65 -27.95 16.27 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.497 -0.752 . . . . 0.0 110.073 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -75.37 -29.08 59.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.337 -0.852 . . . . 0.0 110.071 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.57 -31.65 14.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.393 -0.817 . . . . 0.0 110.218 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.11 -25.33 60.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.34 -0.85 . . . . 0.0 110.29 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.77 -28.04 20.74 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.248 -0.908 . . . . 0.0 110.255 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -90.24 -42.04 11.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.336 -0.852 . . . . 0.0 110.116 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -109.41 36.22 3.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.382 -0.824 . . . . 0.0 110.207 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.38 -75.46 0.04 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.8 pp -78.58 -23.43 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.337 -1.096 . . . . 0.0 110.386 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 51' ' ' GLU . . . -80.44 59.13 3.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.353 -0.842 . . . . 0.0 110.21 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.8 p -147.02 157.91 43.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.345 -0.847 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p -84.63 -170.89 3.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.267 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.64 -104.02 0.23 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -137.46 79.3 1.74 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -1.088 . . . . 0.0 110.222 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.75 71.37 0.79 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.371 -0.831 . . . . 0.0 110.153 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.74 -58.67 4.23 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.316 -0.865 . . . . 0.0 110.373 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.505 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 3.1 m -113.85 69.57 0.71 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.406 -0.809 . . . . 0.0 110.332 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -77.28 -54.78 6.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.12 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.18 -27.11 60.66 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.22 -0.925 . . . . 0.0 109.084 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.505 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -62.39 -42.17 99.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.629 -0.829 . . . . 0.0 108.807 179.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.54 -30.38 70.67 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.44 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -77.1 -35.22 56.56 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.569 -0.707 . . . . 0.0 109.774 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.79 -55.91 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.337 -179.907 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -44.29 67.19 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 110.536 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.2 m -67.06 -44.69 79.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.409 -0.807 . . . . 0.0 110.618 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.8 tp -80.52 -12.08 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.275 -0.891 . . . . 0.0 110.259 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.6 m -76.05 -41.52 50.45 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -82.26 -24.56 34.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.452 -0.78 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -86.05 -35.78 20.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.309 -0.869 . . . . 0.0 110.366 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.28 -45.03 50.29 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.297 -0.877 . . . . 0.0 110.34 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.78 -27.67 69.05 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.285 -0.885 . . . . 0.0 110.162 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.7 -48.38 42.97 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -99.86 132.14 45.4 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.405 -1.056 . . . . 0.0 110.013 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.492 HG23 ' H ' ' A' ' 80' ' ' GLY . 0.0 OUTLIER -145.37 -92.42 0.1 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.383 -0.823 . . . . 0.0 110.069 -179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.492 ' H ' HG23 ' A' ' 79' ' ' THR . . . -91.81 4.88 79.25 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.75 ' O ' HD12 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -170.31 154.0 4.67 Favored Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.191 -1.182 . . . . 0.0 109.015 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.4 63.86 5.44 Favored 'Trans proline' 0 C--N 1.302 -1.881 0 O-C-N 123.535 1.282 . . . . 0.0 110.379 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -53.49 102.8 0.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.458 -0.776 . . . . 0.0 110.423 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.51 -25.27 13.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.844 . . . . 0.0 110.23 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.2 t -58.58 -25.46 62.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.339 -0.85 . . . . 0.0 110.295 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.1 p -95.5 -24.06 16.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.378 -0.827 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 21.7 mtt -76.15 125.15 28.62 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.347 -0.845 . . . . 0.0 110.176 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.9 p -77.92 -163.81 0.45 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 110.281 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.563 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.3 pt-20 -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.538 -0.726 . . . . 0.0 109.268 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.443 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.6 mt-10 -85.43 -40.07 16.84 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.01 -42.73 97.05 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -69.57 -34.9 74.83 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.67 -37.15 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.879 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.79 -34.87 79.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -77.82 -44.59 26.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.565 -0.709 . . . . 0.0 109.926 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.86 -33.38 72.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.369 -0.832 . . . . 0.0 110.065 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.9 tpp -80.58 -21.91 41.21 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.801 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -73.09 -38.9 66.22 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.459 -0.775 . . . . 0.0 110.028 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 92.6 mtp -84.55 -18.31 36.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.376 -0.828 . . . . 0.0 110.389 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.73 -24.8 22.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.203 -0.935 . . . . 0.0 110.277 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 tp -95.37 14.07 23.7 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.586 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -26.15 38.99 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.94 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 168.83 83.93 0.05 OUTLIER Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.85 80.63 3.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -1.087 . . . . 0.0 110.176 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.61 -62.25 2.0 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.839 . . . . 0.0 110.283 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.25 -68.16 0.4 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.396 -0.815 . . . . 0.0 110.18 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.1 -33.27 6.71 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -118.8 86.23 2.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.352 -1.087 . . . . 0.0 110.143 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -162.9 89.11 0.63 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.4 -0.813 . . . . 0.0 110.226 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -127.4 -60.35 1.19 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.431 -0.793 . . . . 0.0 110.185 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 t -77.29 -68.91 0.57 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.399 -0.813 . . . . 0.0 110.228 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.177 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.443 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.9 ttp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.131 0.491 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -89.98 139.87 30.19 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.335 -0.853 . . . . 0.0 109.779 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 21.9 pt -137.56 159.64 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.915 . . . . 0.0 110.353 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.92 143.54 42.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.713 -0.617 . . . . 0.0 110.517 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 65.0 t -128.02 121.07 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.321 -0.862 . . . . 0.0 109.854 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 4.0 mtpt -99.98 128.13 46.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.181 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.7 p -95.9 177.27 5.82 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.485 -0.759 . . . . 0.0 110.506 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.489 HD21 HG22 ' B' ' 70' ' ' VAL . 4.6 mm? -61.35 -14.46 27.46 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.557 -0.714 . . . . 0.0 110.956 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.7 p -95.61 17.74 14.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.154 -0.966 . . . . 0.0 110.683 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.12 11.06 58.11 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 6.2 tmtm? -85.0 132.63 34.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.08 -1.247 . . . . 0.0 109.816 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -113.19 125.19 54.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.396 -0.815 . . . . 0.0 110.273 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.7 mt -109.31 135.4 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 110.405 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.3 m -102.32 118.48 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.194 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -123.5 164.22 19.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.229 -0.92 . . . . 0.0 110.916 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -106.38 116.99 32.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.495 -0.753 . . . . 0.0 109.423 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.459 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.7 m -140.17 174.98 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.841 . . . . 0.0 110.746 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -113.1 165.81 12.43 Favored Pre-proline 0 N--CA 1.488 1.444 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.69 -26.13 16.53 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 123.617 1.325 . . . . 0.0 110.398 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.51 -4.0 58.71 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.057 -1.027 . . . . 0.0 110.508 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.22 138.84 49.82 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.54 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 68.0 p -83.37 160.24 21.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.482 -0.761 . . . . 0.0 110.248 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.705 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.22 -28.98 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.93 -40.51 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 109.38 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASN . . . . . 0.405 ' ND2' ' OG1' ' B' ' 22' ' ' THR . 49.2 m-80 -70.14 -31.36 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.544 -0.722 . . . . 0.0 109.483 179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 81.8 t -70.16 -40.97 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.773 . . . . 0.0 109.27 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -62.99 -42.98 99.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.406 -0.809 . . . . 0.0 109.238 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -34.29 75.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.47 -0.769 . . . . 0.0 109.475 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.459 ' CD ' HG12 ' B' ' 17' ' ' VAL . 21.9 mttp -68.03 -39.97 83.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.524 -0.735 . . . . 0.0 109.674 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.506 HD13 HD22 ' B' ' 69' ' ' LEU . 18.7 mt -67.15 -37.68 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 0.0 109.071 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -52.08 66.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.813 . . . . 0.0 109.68 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -58.13 -27.63 63.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.451 -0.781 . . . . 0.0 110.643 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.03 -38.2 21.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.164 -0.96 . . . . 0.0 110.854 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -108.07 -56.43 2.24 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.226 -0.921 . . . . 0.0 110.502 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.15 17.64 1.98 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.499 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.9 mt -91.44 143.59 28.39 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.076 -1.249 . . . . 0.0 109.785 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -67.66 133.44 29.72 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.65 1.342 . . . . 0.0 110.415 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.69 -26.7 83.47 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.732 1.386 . . . . 0.0 110.849 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -24.89 64.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.84 . . . . 0.0 109.956 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.418 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.1 mt-30 -101.31 3.11 40.4 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.348 -0.845 . . . . 0.0 110.465 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -94.17 137.65 33.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.124 -0.985 . . . . 0.0 110.327 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -130.06 129.52 43.73 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.429 -0.794 . . . . 0.0 109.863 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.793 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.9 mt -104.45 116.89 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.397 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.793 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.37 135.36 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.482 -0.761 . . . . 0.0 109.675 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.483 ' HB2' HD23 ' B' ' 67' ' ' LEU . 44.0 t80 -141.12 154.06 45.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 26.73 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.481 -0.762 . . . . 0.0 111.329 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.99 -3.74 74.54 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.159 -1.02 . . . . 0.0 110.621 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 136.93 49.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.976 -1.308 . . . . 0.0 110.31 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.29 134.92 37.45 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.21 -0.931 . . . . 0.0 109.832 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.665 HD22 ' CG ' ' B' ' 59' ' ' TYR . 26.7 mt -83.96 144.77 28.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' GLU . . . . . 0.403 ' HB2' ' CG ' ' B' ' 54' ' ' ARG . 56.0 mm-40 -93.65 130.59 39.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.378 -0.826 . . . . 0.0 110.433 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.426 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.4 p30 -48.58 -26.83 2.41 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.522 -0.736 . . . . 0.0 111.435 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.64 -5.16 89.72 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.403 ' CG ' ' HB2' ' B' ' 51' ' ' GLU . 13.5 mmt180 -99.6 157.91 16.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.076 -1.249 . . . . 0.0 110.45 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 65.2 p -102.63 161.5 13.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.82 . . . . 0.0 110.212 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.546 HD22 HG21 ' B' ' 61' ' ' ILE . 68.7 mt -53.63 -47.34 70.36 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.389 -0.819 . . . . 0.0 110.626 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.8 t -56.74 -37.0 70.4 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.432 -0.793 . . . . 0.0 111.17 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.33 -26.62 65.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.147 -0.971 . . . . 0.0 110.24 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.665 ' CG ' HD22 ' B' ' 50' ' ' LEU . 25.3 m-85 -101.04 27.16 6.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.379 -0.826 . . . . 0.0 109.829 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.64 28.01 3.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.444 -0.785 . . . . 0.0 110.688 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.546 HG21 HD22 ' B' ' 56' ' ' LEU . 88.8 mt -81.56 112.01 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.362 -0.836 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -105.66 171.7 7.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 64' ' ' GLU . 0.9 OUTLIER -46.62 157.18 0.15 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.514 -0.741 . . . . 0.0 111.268 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' B' ' 64' ' ' GLU . 0.0 OUTLIER 63.81 8.36 3.76 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.791 177.322 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -71.54 142.36 50.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.018 -1.051 . . . . 0.0 110.153 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 23.4 m -107.77 113.51 26.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.36 -0.837 . . . . 0.0 109.973 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.483 HD23 ' HB2' ' B' ' 45' ' ' PHE . 1.7 mt -102.18 164.18 11.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.33 -0.856 . . . . 0.0 110.048 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -108.58 128.87 55.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.32 -0.863 . . . . 0.0 109.959 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.506 HD22 HD13 ' B' ' 30' ' ' ILE . 48.0 tp -107.02 132.71 52.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.277 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.489 HG22 HD21 ' B' ' 8' ' ' LEU . 41.5 t -124.67 152.76 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.375 -0.828 . . . . 0.0 110.181 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 mt -94.53 107.71 19.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.397 -0.814 . . . . 0.0 110.247 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -77.56 131.87 38.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.314 -0.866 . . . . 0.0 110.13 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 97.2 mt -94.08 178.95 5.48 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.427 -0.795 . . . . 0.0 110.278 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.29 103.63 8.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.366 -0.834 . . . . 0.0 110.138 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.75 73.1 0.47 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 CA-C-O 117.97 -1.461 . . . . 0.0 109.54 -179.968 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.161 0.505 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.2 mtp -68.35 -176.57 0.77 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.357 -0.839 . . . . 0.0 110.14 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.0 tp -111.28 26.08 11.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.514 -0.742 . . . . 0.0 109.411 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -99.31 67.6 0.61 Allowed Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.49 -24.92 65.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.312 -1.111 . . . . 0.0 110.218 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.53 59.01 4.85 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.16 -54.99 0.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.364 -1.08 . . . . 0.0 110.182 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.5 t -86.17 -13.65 46.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 0.0 110.503 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -59.37 -19.52 47.47 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.302 -0.874 . . . . 0.0 110.428 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.448 ' CD2' ' O ' ' A' ' 10' ' ' PHE . 34.0 p90 -149.22 116.36 6.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.195 -0.941 . . . . 0.0 110.209 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -113.97 65.76 0.66 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.308 -0.87 . . . . 0.0 110.029 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 53.74 23.78 3.94 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.317 -0.864 . . . . 0.0 110.536 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -123.2 28.65 5.52 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 -51.4 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.425 -1.044 . . . . 0.0 109.982 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -122.11 164.05 28.0 Favored Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.489 -0.757 . . . . 0.0 109.416 179.934 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.827 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 34.8 Cg_endo -57.38 76.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.877 1.461 . . . . 0.0 111.793 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.506 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER 67.79 40.86 2.31 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.556 0.694 . . . . 0.0 109.924 179.391 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.458 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 41.99 31.61 0.24 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.165 0.507 . . . . 0.0 110.936 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.72 116.9 0.94 Allowed Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -71.26 -14.24 31.3 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.049 1.552 . . . . 0.0 109.894 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.96 -31.94 64.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.413 -0.804 . . . . 0.0 109.116 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.6 tp -84.34 -31.22 24.93 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.827 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -65.04 -34.85 79.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.583 -0.698 . . . . 0.0 109.32 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.612 ' O ' HG23 ' A' ' 28' ' ' VAL . 15.6 tp -82.34 -32.5 29.3 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.603 -0.685 . . . . 0.0 109.803 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.24 -39.69 89.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.299 -0.875 . . . . 0.0 109.864 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.554 HD11 ' O ' ' B' ' 47' ' ' GLY . 1.9 tp -83.04 -22.13 33.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.356 -0.84 . . . . 0.0 110.331 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -79.27 -32.28 43.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.263 -0.898 . . . . 0.0 108.583 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 24' ' ' LEU . 63.1 t -84.45 -28.58 6.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.405 ' HB3' ' N ' ' B' ' 47' ' ' GLY . 0.4 OUTLIER -69.67 -46.14 66.77 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.558 -0.714 . . . . 0.0 109.853 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -68.84 -41.56 78.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.453 -0.779 . . . . 0.0 109.983 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -60.19 -39.14 85.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.419 -0.801 . . . . 0.0 110.028 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -38.59 88.54 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.469 -0.769 . . . . 0.0 109.863 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -62.35 -39.35 92.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.828 . . . . 0.0 110.008 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.09 89.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.37 -0.831 . . . . 0.0 109.896 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -33.54 75.71 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.377 -0.827 . . . . 0.0 109.853 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -40.53 18.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.414 -0.804 . . . . 0.0 109.975 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.535 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 7.7 mm-40 -71.49 -23.26 61.77 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.419 -0.8 . . . . 0.0 110.094 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -83.86 -58.11 2.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.48 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.76 -30.16 43.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.445 -0.784 . . . . 0.0 109.103 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -84.91 -39.14 18.55 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.758 -0.589 . . . . 0.0 109.506 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.02 -54.62 17.08 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.897 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.6 mtt-85 -59.92 -35.81 75.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.413 -0.804 . . . . 0.0 110.213 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -58.54 -39.16 79.42 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.211 -0.931 . . . . 0.0 109.96 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.83 -29.37 44.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.441 -0.787 . . . . 0.0 109.938 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.54 -30.21 62.93 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.461 -0.774 . . . . 0.0 110.04 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.52 -45.04 22.87 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.452 -0.78 . . . . 0.0 110.072 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.53 93.15 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.361 -0.837 . . . . 0.0 110.061 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -73.67 -43.25 59.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.424 -0.797 . . . . 0.0 110.061 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.75 -44.58 95.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 110.052 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.3 -26.86 68.24 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.505 -0.747 . . . . 0.0 110.134 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.52 21.75 16.19 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.387 -0.821 . . . . 0.0 110.195 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -143.68 -45.4 0.28 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 110.015 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.58 -44.93 38.54 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.597 HG23 ' O ' ' A' ' 54' ' ' ILE . 5.6 tp -115.2 73.31 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.468 -1.019 . . . . 0.0 110.051 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.73 -151.18 0.08 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.335 -0.853 . . . . 0.0 110.059 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 12.9 p -52.62 145.14 12.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.205 -0.934 . . . . 0.0 110.44 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.5 m -73.78 -63.09 1.28 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.335 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.59 -99.81 0.14 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.674 -1.371 . . . . 0.0 109.674 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.6 m -124.32 100.24 6.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.374 -1.074 . . . . 0.0 110.273 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -167.56 102.93 0.5 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.304 -0.873 . . . . 0.0 110.106 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -146.37 -62.6 0.31 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 110.39 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 28.1 m -133.63 85.31 2.19 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.431 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -63.29 -33.63 75.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.327 -0.858 . . . . 0.0 110.095 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -75.31 -28.44 59.68 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.234 -0.916 . . . . 0.0 109.191 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -62.66 -36.19 82.06 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.692 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -31.58 68.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -74.58 -42.58 58.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.479 -0.763 . . . . 0.0 109.511 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.2 OUTLIER -78.42 -53.06 7.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.471 -0.768 . . . . 0.0 110.321 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 ttp -53.55 -40.99 66.01 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.204 -0.935 . . . . 0.0 110.524 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.2 m -64.78 -47.38 78.34 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.441 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.6 tp -82.45 -11.69 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.9 . . . . 0.0 110.391 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 31.8 t -72.9 -46.85 50.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 109.8 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -81.85 -26.28 34.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.812 . . . . 0.0 109.908 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.04 -27.22 39.46 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.318 -0.864 . . . . 0.0 110.245 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -85.74 -49.23 8.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -48.35 79.52 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.393 -0.817 . . . . 0.0 110.165 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.01 -49.14 78.2 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.91 110.0 22.13 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.383 -1.069 . . . . 0.0 110.07 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -130.38 49.61 2.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.398 -0.814 . . . . 0.0 110.25 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.02 34.84 5.3 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -173.32 150.56 1.88 Allowed Pre-proline 0 N--CA 1.488 1.433 0 O-C-N 121.377 -1.072 . . . . 0.0 108.924 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -76.25 39.84 0.71 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 123.52 1.274 . . . . 0.0 110.8 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 50.78 56.41 8.03 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.139 -0.976 . . . . 0.0 110.62 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -24.07 67.68 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.289 -0.882 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.7 m -59.73 -19.49 50.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.327 -0.858 . . . . 0.0 110.515 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.1 t -98.14 -8.8 26.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.218 -0.926 . . . . 0.0 110.504 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.47 121.9 37.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.266 -0.896 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 66.4 p -77.66 -162.2 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.834 . . . . 0.0 110.376 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.549 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 pt-20 -69.39 -31.08 69.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.484 -0.76 . . . . 0.0 109.114 179.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.456 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.6 OUTLIER -85.27 -39.54 17.62 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.856 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -63.92 -46.08 86.39 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -65.63 -34.22 77.73 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.549 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.2 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.863 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.71 90.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.506 -0.746 . . . . 0.0 109.722 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -44.56 93.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.419 -0.801 . . . . 0.0 110.051 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.67 -31.1 61.81 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.863 . . . . 0.0 110.361 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.0 tpt -83.42 -24.97 31.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.367 -0.833 . . . . 0.0 110.023 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -38.29 63.58 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.0 110.081 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.7 mtm -81.26 -23.76 37.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.318 -0.864 . . . . 0.0 110.243 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.9 m -80.22 -29.15 38.5 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' A' ' 101' ' ' LEU . 2.3 mm? -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.307 -0.871 . . . . 0.0 110.454 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.81 -35.08 4.92 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.109 -0.994 . . . . 0.0 110.2 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -80.76 -46.82 7.01 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -110.06 67.99 0.66 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.413 -1.051 . . . . 0.0 110.161 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.88 -22.55 62.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.793 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -95.26 39.73 1.11 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.266 -0.896 . . . . 0.0 110.3 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -119.95 44.75 1.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -106.23 52.86 0.72 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.256 -1.144 . . . . 0.0 110.246 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.38 -50.11 0.15 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.273 -0.892 . . . . 0.0 110.194 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -89.14 84.26 6.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.386 -0.821 . . . . 0.0 110.182 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 -49.54 0.24 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.372 -0.83 . . . . 0.0 110.217 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.19 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.342 0.592 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -103.07 147.03 27.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.0 110.109 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.703 HD13 HG21 ' B' ' 17' ' ' VAL . 38.3 pt -137.52 158.28 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -111.99 143.84 42.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.598 -0.689 . . . . 0.0 110.613 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 63.8 t -127.89 120.75 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.46 -0.775 . . . . 0.0 109.491 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.1 mtpt -100.03 129.81 46.12 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.409 -0.807 . . . . 0.0 110.568 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.573 HG22 HD23 ' B' ' 69' ' ' LEU . 32.2 p -95.81 175.98 6.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.401 -0.812 . . . . 0.0 110.283 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.442 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.5 mm? -61.16 -15.97 39.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.794 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.4 p -95.96 20.45 10.03 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.097 -1.002 . . . . 0.0 110.765 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.87 13.78 59.86 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.5 tttp -84.76 130.09 34.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.051 -1.264 . . . . 0.0 109.768 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.1 m -113.05 124.96 53.83 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.143 -0.973 . . . . 0.0 110.439 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 6.5 mt -109.32 133.23 55.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.409 -0.807 . . . . 0.0 110.259 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.7 m -102.38 118.76 37.55 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.371 -0.831 . . . . 0.0 109.564 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 67.9 mt -123.42 168.69 12.22 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.218 -0.926 . . . . 0.0 110.792 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.61 116.03 31.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.399 -0.813 . . . . 0.0 109.642 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.703 HG21 HD13 ' B' ' 3' ' ' ILE . 35.0 m -140.43 169.77 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.696 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.509 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.1 mp0 -112.62 166.07 11.77 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.57 -0.706 . . . . 0.0 109.294 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.16 -25.63 18.82 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 123.538 1.283 . . . . 0.0 110.313 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -84.33 -3.56 58.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.506 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.21 141.41 50.63 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.178 -0.951 . . . . 0.0 110.465 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 46.4 p -83.17 157.13 22.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.54 -0.725 . . . . 0.0 110.367 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.503 HG23 HD12 ' B' ' 43' ' ' LEU . 43.0 mm -59.55 -35.3 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.292 -0.88 . . . . 0.0 109.435 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.16 -37.26 79.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.458 -0.776 . . . . 0.0 109.276 179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.32 -30.15 67.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.553 -0.717 . . . . 0.0 109.296 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 22' ' ' THR . 60.2 t -70.54 -41.44 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.468 -0.77 . . . . 0.0 109.16 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -62.85 -43.82 97.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.403 -0.81 . . . . 0.0 109.151 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -31.71 71.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.73 . . . . 0.0 109.289 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.451 ' HE2' HG12 ' B' ' 17' ' ' VAL . 13.4 mttp -68.35 -40.36 81.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.556 -0.715 . . . . 0.0 109.363 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.8 mt -67.09 -37.56 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.024 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 54.9 tt0 -60.78 -51.76 67.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.376 -0.827 . . . . 0.0 109.631 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.15 -27.1 63.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.433 -0.792 . . . . 0.0 110.592 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.93 -41.72 17.07 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.294 -0.879 . . . . 0.0 110.865 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -108.13 -53.72 2.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.217 -0.927 . . . . 0.0 110.427 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.5 19.74 2.04 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.151 -1.18 . . . . 0.0 110.151 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.489 HG23 ' HD2' ' B' ' 37' ' ' PRO . 51.8 mt -91.39 143.42 28.18 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.108 -1.231 . . . . 0.0 109.823 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -69.69 133.04 24.74 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.663 1.349 . . . . 0.0 110.437 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.84 -25.78 81.86 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 O-C-N 123.705 1.371 . . . . 0.0 110.845 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -68.78 -25.2 64.58 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.304 -0.873 . . . . 0.0 109.88 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 29.5 mm-40 -101.33 5.16 42.19 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.433 -0.792 . . . . 0.0 110.46 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLN . . . . . 0.429 ' HG2' HD11 ' B' ' 69' ' ' LEU . 6.9 mt-30 -94.26 141.82 28.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.0 110.425 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.12 124.46 32.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.447 -0.783 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 28.1 mt -104.6 118.19 35.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.217 -0.927 . . . . 0.0 110.274 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.8 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -120.89 133.04 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.571 -0.706 . . . . 0.0 109.714 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.527 ' HB2' HD23 ' B' ' 67' ' ' LEU . 29.1 t80 -140.87 147.21 38.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.429 -0.794 . . . . 0.0 110.064 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.27 28.79 0.47 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.76 . . . . 0.0 111.191 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.554 ' O ' HD11 ' A' ' 26' ' ' LEU . . . 78.49 2.91 85.72 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -111.13 134.79 52.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.045 -1.268 . . . . 0.0 110.243 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -78.46 134.46 37.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 109.406 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.7 HD12 ' HB3' ' B' ' 43' ' ' LEU . 35.0 mt -83.88 137.07 33.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.239 -0.913 . . . . 0.0 110.361 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -93.76 130.64 39.67 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.791 . . . . 0.0 110.41 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.461 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.39 -26.87 2.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.494 -0.754 . . . . 0.0 111.211 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.81 86.69 Favored Glycine 0 N--CA 1.494 2.547 0 C-N-CA 120.046 -1.073 . . . . 0.0 110.608 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -99.42 156.28 17.1 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.045 -1.268 . . . . 0.0 110.483 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.6 p -102.42 163.84 12.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.373 -0.829 . . . . 0.0 110.158 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.509 HD12 ' O ' ' B' ' 18' ' ' GLU . 85.6 mt -53.5 -44.47 69.11 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.313 -0.867 . . . . 0.0 110.465 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 27.4 p -56.86 -36.31 69.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.398 -0.814 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.59 -27.96 66.73 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.099 -1.001 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.553 ' CD2' HD22 ' B' ' 50' ' ' LEU . 50.4 m-85 -101.13 27.54 6.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 109.93 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 50.6 28.2 3.34 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.604 -0.685 . . . . 0.0 110.683 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.485 HD12 ' HA ' ' B' ' 56' ' ' LEU . 90.9 mt -81.54 108.87 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.93 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.58 174.68 5.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.344 -0.847 . . . . 0.0 110.065 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.56 153.37 0.38 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.465 -0.772 . . . . 0.0 111.022 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 7.6 mt-10 62.64 16.32 8.77 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.667 -0.645 . . . . 0.0 110.681 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.55 142.05 50.08 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 20.3 m -107.64 109.93 21.67 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.334 -0.854 . . . . 0.0 110.115 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.527 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.2 mt -102.54 160.72 14.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.84 . . . . 0.0 110.101 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -108.83 132.66 53.79 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.306 -0.871 . . . . 0.0 110.043 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.573 HD23 HG22 ' B' ' 7' ' ' THR . 54.7 tp -107.28 129.38 54.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.305 -0.872 . . . . 0.0 110.184 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.6 t -125.01 157.64 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.46 -0.775 . . . . 0.0 110.071 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.13 162.94 13.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.357 -0.839 . . . . 0.0 110.122 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -147.26 100.16 3.24 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.255 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mp -105.82 114.61 28.87 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.315 -0.865 . . . . 0.0 110.233 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -63.68 179.35 0.49 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.349 -0.844 . . . . 0.0 110.203 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 135.16 -36.92 1.99 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 CA-C-O 117.905 -1.497 . . . . 0.0 109.552 179.998 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.0 t60 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.232 0.539 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -167.36 -172.22 1.91 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.421 -0.799 . . . . 0.0 110.086 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt -113.44 26.57 10.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.441 -0.787 . . . . 0.0 109.643 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.59 64.9 1.42 Allowed Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.512 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.9 OUTLIER -160.74 70.33 0.39 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.329 -1.101 . . . . 0.0 110.303 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -126.16 137.58 10.23 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.6 72.15 5.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -1.099 . . . . 0.0 110.16 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.6 p -148.94 -45.09 0.14 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.345 -0.847 . . . . 0.0 110.184 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.39 -34.98 68.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.395 -0.815 . . . . 0.0 110.151 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.437 ' HA ' HG13 ' A' ' 14' ' ' VAL . 29.8 m-85 -97.89 14.58 26.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.334 -0.854 . . . . 0.0 110.426 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -76.57 82.79 3.24 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.861 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 52.75 42.42 31.77 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.405 -0.809 . . . . 0.0 110.359 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -138.96 20.92 3.02 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.437 HG13 ' HA ' ' A' ' 10' ' ' PHE . 34.8 m -120.46 -31.85 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.2 -1.176 . . . . 0.0 110.374 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.499 ' CG ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -123.36 163.48 33.87 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.602 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 34.2 Cg_endo -56.8 76.11 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.956 1.503 . . . . 0.0 112.095 -178.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.499 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.1 t 67.88 36.51 3.43 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 121.541 0.686 . . . . 0.0 110.231 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.462 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 44.78 25.4 0.14 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.071 0.462 . . . . 0.0 111.153 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.94 117.44 0.52 Allowed Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.116 -0.99 . . . . 0.0 110.166 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -71.27 -14.17 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.012 1.533 . . . . 0.0 110.095 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -75.27 -32.67 61.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.38 -0.825 . . . . 0.0 109.322 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.77 -29.48 27.39 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.602 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -74.08 -36.08 64.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.592 -0.693 . . . . 0.0 109.447 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.73 ' O ' HG23 ' A' ' 28' ' ' VAL . 41.9 tp -78.7 -34.89 45.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.581 -0.7 . . . . 0.0 109.69 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.82 -35.81 81.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.394 -0.816 . . . . 0.0 109.92 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.437 HD21 ' HA3' ' B' ' 47' ' ' GLY . 0.6 OUTLIER -78.83 -23.14 45.23 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.486 -0.759 . . . . 0.0 110.207 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -27.46 38.78 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.285 -0.885 . . . . 0.0 109.333 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 24' ' ' LEU . 57.7 t -80.79 -27.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.558 -0.714 . . . . 0.0 109.757 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 m -78.54 -31.76 47.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.386 -0.821 . . . . 0.0 110.036 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.55 -34.33 47.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.432 -0.793 . . . . 0.0 110.017 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.17 -32.73 63.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 110.068 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -73.74 -39.72 64.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -0.846 . . . . 0.0 110.25 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -64.53 -41.82 96.13 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.366 -0.834 . . . . 0.0 110.15 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.01 -39.99 90.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.301 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.86 -44.78 86.81 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.374 -0.828 . . . . 0.0 110.208 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -77.27 -43.28 33.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.361 -0.837 . . . . 0.0 110.123 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.684 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.7 mm100 -66.14 -28.21 68.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.828 . . . . 0.0 110.211 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -83.98 -57.89 3.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.449 -0.782 . . . . 0.0 109.777 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.06 -34.28 42.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.426 -0.796 . . . . 0.0 109.347 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.41 -34.1 28.39 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.684 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.58 -49.43 71.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.431 -0.793 . . . . 0.0 109.828 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.22 -32.22 64.62 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.894 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -53.79 -36.43 62.43 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.214 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.1 -27.22 35.69 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.546 -0.721 . . . . 0.0 109.126 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.03 -29.5 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.553 -0.717 . . . . 0.0 109.843 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.91 -38.02 13.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.451 -0.78 . . . . 0.0 110.014 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.94 -36.95 70.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.784 . . . . 0.0 110.077 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -37.63 47.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.44 -0.787 . . . . 0.0 109.975 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.68 -29.13 70.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.823 . . . . 0.0 110.073 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.44 -21.83 57.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.452 -0.78 . . . . 0.0 110.293 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -76.59 -62.6 1.57 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.261 -0.9 . . . . 0.0 110.237 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -119.78 36.94 4.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.408 -0.808 . . . . 0.0 110.359 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -129.43 -60.93 0.1 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.513 ' O ' HG22 ' A' ' 54' ' ' ILE . 37.5 mm -90.4 73.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -1.045 . . . . 0.0 110.096 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -167.91 63.2 0.07 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.324 -0.86 . . . . 0.0 110.188 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.41 133.36 37.52 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.341 -0.85 . . . . 0.0 110.077 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 24.7 m -132.51 120.7 22.24 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.31 43.28 0.4 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -115.03 53.07 0.83 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -1.136 . . . . 0.0 110.19 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.54 56.86 1.15 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.267 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -62.27 -63.36 1.26 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.277 -0.889 . . . . 0.0 110.131 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.435 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 1.5 m -84.81 78.81 9.81 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.351 -0.843 . . . . 0.0 110.049 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.39 -61.87 1.64 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.336 -0.852 . . . . 0.0 110.35 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -77.67 -28.67 51.2 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.183 -0.948 . . . . 0.0 109.517 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.435 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -63.54 -35.26 79.89 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.414 -0.915 . . . . 0.0 108.786 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 70' ' ' THR . 14.1 tp -73.04 -30.94 64.11 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -77.55 -34.35 53.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.595 -0.69 . . . . 0.0 109.669 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.47 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -84.63 -51.29 6.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 109.926 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.33 -38.62 63.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.275 -0.891 . . . . 0.0 110.425 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 66' ' ' LEU . 14.4 t -74.59 -36.27 63.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.243 -0.911 . . . . 0.0 110.474 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.47 HG22 ' HA ' ' A' ' 68' ' ' LYS . 3.4 tp -85.45 -14.01 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.387 -0.821 . . . . 0.0 110.323 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' LYS . 35.5 t -83.82 -33.41 24.93 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.926 . . . . 0.0 109.992 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.86 -24.31 19.38 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.299 -0.876 . . . . 0.0 110.185 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -32.9 10.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.32 -0.863 . . . . 0.0 110.232 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.462 ' C ' ' CG ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -110.5 -12.97 14.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.366 -0.834 . . . . 0.0 110.607 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.462 ' CG ' ' C ' ' A' ' 75' ' ' GLU . 13.9 p90 31.49 57.89 0.29 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.567 -0.708 . . . . 0.0 111.769 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.51 -63.73 3.12 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -43.01 6.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.411 -1.053 . . . . 0.0 110.016 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.67 HG22 ' O ' ' A' ' 79' ' ' THR . 67.1 m 51.73 26.07 3.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.343 -0.848 . . . . 0.0 110.022 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 94.01 -89.42 1.27 Allowed Glycine 0 N--CA 1.489 2.228 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.587 HD23 ' HD2' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -178.18 146.87 0.57 Allowed Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.529 -0.983 . . . . 0.0 109.154 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.587 ' HD2' HD23 ' A' ' 81' ' ' LEU . 46.6 Cg_endo -73.49 50.68 2.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.517 1.272 . . . . 0.0 110.523 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.32 84.74 1.43 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.244 -0.91 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 -28.79 63.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.374 -0.829 . . . . 0.0 110.201 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.8 m -59.2 -24.63 63.28 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.347 -0.845 . . . . 0.0 110.58 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.7 t -99.85 -25.17 14.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.34 -0.85 . . . . 0.0 110.447 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.5 mtt -75.16 120.41 20.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -0.885 . . . . 0.0 110.161 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.489 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 77.4 p -74.0 -158.07 0.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.498 -0.751 . . . . 0.0 110.426 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.58 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 2.8 mt-10 -73.53 -29.85 62.72 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.559 -0.713 . . . . 0.0 109.077 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.44 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 31.7 mt-10 -85.09 -36.97 20.81 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.489 ' HB2' ' N ' ' A' ' 88' ' ' THR . 7.8 mm-40 -66.19 -45.27 81.42 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -66.47 -34.79 78.73 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.58 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -65.61 -36.24 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 178.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.41 71.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.494 -0.754 . . . . 0.0 109.613 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -84.52 -46.13 11.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.462 -0.774 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.44 -30.92 67.89 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.417 -0.802 . . . . 0.0 110.505 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.4 ttm -82.3 -25.52 33.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.285 -0.884 . . . . 0.0 109.971 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.06 -33.13 65.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 110.147 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 mtt -87.33 -25.87 23.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.465 -0.772 . . . . 0.0 110.316 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.4 t -76.49 -43.32 40.11 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.361 -0.837 . . . . 0.0 110.548 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.49 ' HA ' HD13 ' A' ' 101' ' ' LEU . 2.5 mm? -68.03 -32.38 72.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.343 -0.848 . . . . 0.0 110.338 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -60.97 -66.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.409 -0.807 . . . . 0.0 110.309 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 156.47 -117.94 0.81 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -169.28 79.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.344 -1.092 . . . . 0.0 110.161 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -86.67 74.82 9.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.346 -0.846 . . . . 0.0 110.207 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -164.28 -66.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.377 -0.827 . . . . 0.0 110.128 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -111.75 -171.14 18.86 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.98 69.36 1.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.301 -1.117 . . . . 0.0 110.279 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.16 -38.7 22.01 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.402 -0.811 . . . . 0.0 110.173 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -77.97 -38.09 45.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.395 -0.816 . . . . 0.0 110.148 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.48 121.11 25.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.382 -0.824 . . . . 0.0 110.046 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 179.982 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.137 0.494 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.24 140.71 29.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.797 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.8 pt -137.38 159.79 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.906 . . . . 0.0 110.291 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.98 143.62 42.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.576 -0.703 . . . . 0.0 110.686 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 82.4 t -127.72 116.87 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.447 -0.783 . . . . 0.0 109.352 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.616 ' HG3' HG23 ' B' ' 12' ' ' THR . 13.4 mttt -100.18 131.87 45.87 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.345 -0.847 . . . . 0.0 110.813 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.433 HG22 HD23 ' B' ' 69' ' ' LEU . 17.5 p -95.99 173.34 7.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.878 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.402 HD11 HG13 ' B' ' 70' ' ' VAL . 8.6 mt -61.66 -12.01 14.31 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.343 -0.848 . . . . 0.0 110.941 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 63.8 p -95.65 16.06 18.31 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.036 -1.04 . . . . 0.0 110.767 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.36 8.59 66.46 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 120.195 -1.003 . . . . 0.0 110.629 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 11.6 tttt -84.75 127.27 34.03 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.052 -1.264 . . . . 0.0 109.905 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.616 HG23 ' HG3' ' B' ' 6' ' ' LYS . 3.5 m -113.24 126.84 55.85 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.977 . . . . 0.0 110.495 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 13.1 mt -109.46 136.67 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.358 -0.839 . . . . 0.0 110.439 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m -102.3 120.52 40.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.1 mt -123.49 162.22 23.31 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.117 -0.99 . . . . 0.0 110.857 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -106.55 116.15 31.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.475 -0.765 . . . . 0.0 109.664 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.24 176.45 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 110.787 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.408 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -113.14 163.24 18.62 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.689 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.44 -26.69 20.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.513 1.27 . . . . 0.0 110.276 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 m -84.54 -2.48 57.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.261 -0.9 . . . . 0.0 110.614 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -71.36 145.15 49.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.541 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.33 156.33 23.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.661 -0.65 . . . . 0.0 110.432 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.451 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.7 mm -59.61 -32.75 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 109.431 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -62.58 -36.74 83.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -70.21 -31.51 68.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.514 -0.742 . . . . 0.0 109.124 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.99 -40.37 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttt -62.92 -40.6 98.12 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -34.75 76.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 109.348 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.9 -39.99 83.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.571 -0.706 . . . . 0.0 109.554 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.0 mt -67.31 -37.62 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.152 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.4 tm0? -60.87 -53.33 58.62 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.469 -0.769 . . . . 0.0 109.833 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.1 -27.73 63.98 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.386 -0.821 . . . . 0.0 110.746 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -84.12 -36.52 22.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 111.167 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -108.07 -53.14 2.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.202 -0.936 . . . . 0.0 110.602 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.61 14.15 3.6 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.471 HG23 ' HD2' ' B' ' 37' ' ' PRO . 69.2 mt -91.37 143.25 27.94 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.107 -1.231 . . . . 0.0 109.874 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.544 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 38.7 Cg_endo -67.4 135.39 36.43 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.61 1.321 . . . . 0.0 110.391 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 -24.74 79.32 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.727 1.383 . . . . 0.0 111.001 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.73 -25.38 64.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.317 -0.865 . . . . 0.0 109.804 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.544 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.58 6.87 44.27 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.533 -0.73 . . . . 0.0 110.541 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -94.3 139.52 30.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.445 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.1 122.82 29.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.452 -0.78 . . . . 0.0 109.845 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.793 ' HB3' HD12 ' B' ' 50' ' ' LEU . 28.0 mt -104.7 116.69 32.47 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.481 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.786 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.12 133.78 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.553 -0.717 . . . . 0.0 109.658 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -140.39 151.64 45.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.458 -0.776 . . . . 0.0 109.807 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.38 28.14 0.44 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.472 -0.768 . . . . 0.0 111.048 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.437 ' HA3' HD21 ' A' ' 26' ' ' LEU . . . 77.52 2.31 79.72 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -111.13 138.3 47.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.246 . . . . 0.0 110.292 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -78.39 135.88 37.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.9 . . . . 0.0 109.459 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.793 HD12 ' HB3' ' B' ' 43' ' ' LEU . 39.8 mt -83.79 138.45 33.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 110.315 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -93.67 127.76 39.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.387 -0.821 . . . . 0.0 110.6 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.33 -26.42 2.02 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 111.135 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -10.45 82.95 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.733 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.25 158.3 15.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.31 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 41.3 p -102.39 166.15 10.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.768 . . . . 0.0 110.373 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.504 ' HA ' HD12 ' B' ' 61' ' ' ILE . 55.4 mt -53.64 -44.21 69.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.317 -0.864 . . . . 0.0 110.751 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 94.0 p -56.83 -36.77 70.36 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.342 -0.849 . . . . 0.0 111.153 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.55 -27.06 65.89 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.135 -0.978 . . . . 0.0 110.532 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.582 ' CD2' HD22 ' B' ' 50' ' ' LEU . 55.2 m-85 -101.06 24.72 8.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.883 . . . . 0.0 110.221 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 50.69 30.33 4.86 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.4 -0.813 . . . . 0.0 110.723 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.528 HD13 HD21 ' B' ' 67' ' ' LEU . 73.5 mt -81.67 113.45 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.29 -0.881 . . . . 0.0 110.015 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.78 170.47 7.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.9 . . . . 0.0 110.262 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.74 153.28 0.41 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.568 -0.707 . . . . 0.0 111.103 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.84 16.1 8.8 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.611 -0.68 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.56 144.59 49.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.153 -0.967 . . . . 0.0 110.082 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.7 m -107.53 110.49 22.43 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.528 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.42 162.62 12.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.368 -0.832 . . . . 0.0 110.213 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.43 ' NE2' HG12 ' A' ' 28' ' ' VAL . 60.4 m80 -109.03 130.58 55.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.363 -0.835 . . . . 0.0 109.941 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.433 HD23 HG22 ' B' ' 7' ' ' THR . 55.0 tp -106.97 127.75 53.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.402 HG13 HD11 ' B' ' 8' ' ' LEU . 48.6 t -124.8 155.0 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.303 -0.873 . . . . 0.0 110.136 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.8 mt -94.18 128.12 40.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.442 -0.786 . . . . 0.0 110.25 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -86.16 70.95 10.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.357 -0.839 . . . . 0.0 110.15 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.36 -176.94 3.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.36 -0.837 . . . . 0.0 110.347 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.67 131.33 3.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.376 -0.827 . . . . 0.0 110.015 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.39 114.36 0.06 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 CA-C-O 117.987 -1.452 . . . . 0.0 109.539 -179.908 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 39.2 m80 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.125 0.488 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.8 mtp -152.04 -174.09 4.75 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.458 -0.776 . . . . 0.0 110.14 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.52 23.87 13.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.0 109.482 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.86 50.32 3.14 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.45 35.29 2.9 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.323 -1.104 . . . . 0.0 110.225 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.2 105.12 0.3 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.58 60.79 4.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.387 -1.066 . . . . 0.0 110.147 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -152.28 -46.04 0.1 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.335 -0.853 . . . . 0.0 110.155 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -61.53 -41.13 96.87 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.379 -0.826 . . . . 0.0 110.159 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.444 ' O ' HG23 ' A' ' 14' ' ' VAL . 0.7 OUTLIER -108.42 63.78 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.456 -0.778 . . . . 0.0 110.06 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.99 136.42 36.6 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.36 -0.837 . . . . 0.0 110.347 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 53.18 24.35 3.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.284 -0.885 . . . . 0.0 110.568 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -137.59 28.36 2.76 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 10' ' ' PHE . 57.4 t -117.69 -33.83 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.365 -1.079 . . . . 0.0 110.122 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.556 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -138.63 -178.89 0.92 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.418 -0.801 . . . . 0.0 109.908 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.825 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.9 Cg_endo -61.13 78.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 123.536 1.282 . . . . 0.0 110.691 -178.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.455 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.1 m 69.04 46.32 0.83 Allowed 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 41.65 30.21 0.14 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.055 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -164.24 116.27 0.98 Allowed Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.238 -0.914 . . . . 0.0 110.544 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -72.62 -14.05 27.34 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.14 1.6 . . . . 0.0 109.656 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.435 ' HB3' ' CG1' ' B' ' 70' ' ' VAL . 31.5 mt-10 -72.67 -35.99 67.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.452 -0.78 . . . . 0.0 109.293 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.5 mt -79.47 -31.11 42.34 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.825 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -65.58 -33.41 75.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.554 -0.716 . . . . 0.0 109.105 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.454 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -82.59 -34.84 27.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.627 -0.671 . . . . 0.0 109.621 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.51 -34.19 67.44 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.391 -0.818 . . . . 0.0 109.724 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.466 HD23 ' HA2' ' B' ' 47' ' ' GLY . 26.6 mt -82.72 -21.04 34.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.284 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.3 -34.67 55.44 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.28 -0.888 . . . . 0.0 108.746 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.448 HG12 ' NE2' ' B' ' 68' ' ' HIS . 91.4 t -79.38 -24.76 12.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.742 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 p -73.28 -46.69 48.3 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.378 -0.826 . . . . 0.0 110.189 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -37.93 82.8 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.4 -0.813 . . . . 0.0 110.169 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -29.28 67.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.432 -0.792 . . . . 0.0 110.098 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.66 -43.67 62.85 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.294 -0.879 . . . . 0.0 110.094 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -69.14 -33.13 72.95 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.328 -0.857 . . . . 0.0 110.057 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.7 -44.59 66.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.103 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.95 -29.23 69.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.361 -0.837 . . . . 0.0 110.332 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.5 mmt85 -86.85 -31.86 20.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.579 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.1 mt-30 -77.24 -27.67 53.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.406 -0.809 . . . . 0.0 110.112 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -84.05 -57.49 3.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.334 -0.854 . . . . 0.0 109.709 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -52.6 -30.97 34.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 109.377 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -87.0 -34.39 19.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.565 -0.709 . . . . 0.0 109.653 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.579 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -71.06 -54.22 11.91 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.22 -0.925 . . . . 0.0 109.982 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.3 mtt-85 -62.08 -48.14 81.54 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.391 -0.818 . . . . 0.0 110.165 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -54.1 -44.5 71.28 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.38 -29.98 60.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.387 -0.821 . . . . 0.0 109.589 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.8 -28.65 64.8 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.412 -0.805 . . . . 0.0 109.877 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.67 -36.91 14.09 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.458 -0.776 . . . . 0.0 110.218 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.75 -31.19 64.74 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.9 m -84.82 -35.54 22.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.414 -0.804 . . . . 0.0 110.239 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.7 67.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.276 -0.89 . . . . 0.0 110.245 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.27 -28.38 47.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.349 -0.844 . . . . 0.0 110.164 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.78 -37.0 27.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.145 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -106.86 24.8 12.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.417 -0.802 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -122.09 -40.66 0.51 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.417 ' HA ' HD13 ' A' ' 54' ' ' ILE . 8.9 mm -85.03 -27.4 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.4 -1.059 . . . . 0.0 110.153 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.58 -51.89 17.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -0.892 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.1 t -67.18 155.6 38.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.347 -0.845 . . . . 0.0 110.168 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.7 m -85.34 100.83 12.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.293 -0.879 . . . . 0.0 110.155 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -142.3 45.87 0.9 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.1 m -92.18 52.09 1.9 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -1.116 . . . . 0.0 110.138 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -110.41 84.97 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -167.53 -48.77 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.321 -0.862 . . . . 0.0 110.299 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.456 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.2 OUTLIER -125.26 68.35 1.14 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.337 -0.852 . . . . 0.0 110.217 -179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.78 -30.79 70.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.384 -0.822 . . . . 0.0 110.323 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -75.9 -29.78 58.58 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.239 -0.913 . . . . 0.0 109.163 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.456 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -62.84 -36.29 82.73 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.434 -0.906 . . . . 0.0 108.69 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -29.09 64.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.489 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.5 tt -78.73 -37.68 40.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.51 -0.744 . . . . 0.0 109.803 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.436 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.04 -50.71 7.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.5 -0.75 . . . . 0.0 110.38 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.3 tpp -57.64 -42.97 84.52 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.264 -0.898 . . . . 0.0 110.438 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.8 m -68.35 -41.73 80.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.337 -0.852 . . . . 0.0 110.571 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.436 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.3 tp -82.95 -14.98 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.253 -0.904 . . . . 0.0 110.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' LYS . 8.2 t -74.15 -45.33 49.43 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.889 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -79.59 -26.42 41.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.44 -0.788 . . . . 0.0 109.956 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -81.65 -40.98 22.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.347 -0.846 . . . . 0.0 110.153 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.84 -44.92 79.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.348 -0.845 . . . . 0.0 110.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.58 94.04 0.08 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.403 -0.811 . . . . 0.0 110.226 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.94 78.8 0.04 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' GLY . 2.2 tmm_? 53.4 57.58 6.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.344 -1.092 . . . . 0.0 110.373 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 79' ' ' THR . 6.8 t -63.37 80.1 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.39 -0.819 . . . . 0.0 109.567 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 75.92 -57.04 3.11 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.759 HD23 ' HD2' ' A' ' 82' ' ' PRO . 0.2 OUTLIER 174.85 147.08 0.23 Allowed Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.633 -0.922 . . . . 0.0 109.136 179.418 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.759 ' HD2' HD23 ' A' ' 81' ' ' LEU . 46.4 Cg_endo -73.31 50.72 1.97 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.505 1.266 . . . . 0.0 110.268 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -54.3 105.62 0.16 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.85 -27.99 61.37 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.378 -0.826 . . . . 0.0 110.023 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.7 t -57.77 -27.47 63.1 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.267 -0.896 . . . . 0.0 110.242 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.4 m -87.02 -27.89 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.354 -0.842 . . . . 0.0 110.106 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.7 mtt -63.27 114.26 3.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.828 . . . . 0.0 110.196 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p -75.66 -159.94 0.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.807 . . . . 0.0 110.574 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.1 mt-10 -71.92 -30.32 65.23 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.462 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mm-40 -83.85 -38.07 21.66 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -45.24 85.3 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.07 -34.2 77.52 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.557 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -67.37 -33.67 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.906 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.74 -28.9 69.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.398 -0.814 . . . . 0.0 109.8 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.78 -39.31 20.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.411 -0.806 . . . . 0.0 110.355 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.95 -29.3 32.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.282 -0.886 . . . . 0.0 110.724 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 tpt -82.27 -27.47 32.38 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.39 -28.84 41.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.478 -0.764 . . . . 0.0 109.764 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.7 ttp -81.55 -26.08 35.34 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.46 -0.775 . . . . 0.0 110.256 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -83.07 -31.8 27.15 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.261 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -36.42 65.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.317 -0.864 . . . . 0.0 110.06 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -86.33 -24.25 25.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.267 -0.895 . . . . 0.0 110.329 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -134.04 97.51 0.3 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.25 67.69 6.16 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.362 -1.081 . . . . 0.0 110.291 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 51.74 44.42 29.28 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.306 -0.871 . . . . 0.0 110.544 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -98.25 31.03 2.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.453 -0.78 . . . . 0.0 110.306 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -96.9 84.06 0.78 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -91.16 50.64 1.8 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.345 -1.091 . . . . 0.0 110.228 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -114.64 -24.71 8.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.352 -0.842 . . . . 0.0 110.399 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -95.79 38.51 1.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.286 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.79 -31.3 25.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.308 -0.87 . . . . 0.0 110.17 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.196 179.886 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.479 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.0 ttp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.213 0.53 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -88.21 138.69 31.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 109.855 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.6 pt -137.42 158.82 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.343 -0.848 . . . . 0.0 110.365 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -111.84 142.55 44.07 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.616 -0.677 . . . . 0.0 110.628 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t -127.97 119.59 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.383 -0.823 . . . . 0.0 109.507 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.453 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.7 mtpm? -100.32 131.15 46.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.803 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.2 p -96.21 176.86 5.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 110.18 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.62 -15.08 36.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.449 -0.782 . . . . 0.0 110.954 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 78.0 p -95.8 19.88 10.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.041 -1.037 . . . . 0.0 110.767 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.91 12.83 58.26 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.06 34.86 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.242 . . . . 0.0 109.729 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 25.1 m -112.88 126.75 55.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.273 -0.892 . . . . 0.0 110.42 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.3 mt -109.31 138.54 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.39 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.3 m -101.93 119.71 39.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.0 109.13 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.405 HD23 ' HE3' ' B' ' 33' ' ' LYS . 30.0 mt -123.47 160.68 26.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.055 -178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 114.91 29.32 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.527 -0.733 . . . . 0.0 109.409 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.479 ' O ' ' HB3' ' B' ' 1' ' ' MET . 28.4 m -140.16 176.99 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 110.882 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.483 ' O ' HD12 ' B' ' 56' ' ' LEU . 5.5 mt-10 -113.29 164.21 16.26 Favored Pre-proline 0 N--CA 1.49 1.536 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.9 -26.07 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 123.543 1.286 . . . . 0.0 110.346 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 -3.13 58.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.212 -0.93 . . . . 0.0 110.739 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.27 144.1 50.14 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.139 -0.976 . . . . 0.0 110.617 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 67.5 p -83.15 158.48 22.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.535 -0.728 . . . . 0.0 110.206 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.854 HG23 HD12 ' B' ' 43' ' ' LEU . 43.7 mm -59.58 -36.97 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 109.542 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.74 -35.46 76.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.453 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -70.44 -32.99 70.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.468 -0.77 . . . . 0.0 109.351 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.94 -39.8 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.0 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.412 ' HE2' HG22 ' B' ' 23' ' ' ILE . 18.6 mtmt -62.99 -41.19 99.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 109.036 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.42 77.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.573 -0.704 . . . . 0.0 109.391 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -37.5 81.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.437 -0.789 . . . . 0.0 109.388 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.4 mt -67.18 -37.46 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.769 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -60.71 -51.28 70.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.549 -0.719 . . . . 0.0 109.531 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -58.13 -27.25 63.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.55 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.405 ' HE3' HD23 ' B' ' 15' ' ' LEU . 21.3 mmtt -84.07 -39.47 19.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.214 -0.929 . . . . 0.0 110.841 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -108.16 -55.75 2.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.249 -0.907 . . . . 0.0 110.6 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.2 14.24 2.03 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.496 HG23 ' HD2' ' B' ' 37' ' ' PRO . 13.8 mt -91.17 143.81 28.95 Favored Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.115 -1.227 . . . . 0.0 109.573 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.7 Cg_endo -68.38 131.74 23.99 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 O-C-N 123.631 1.332 . . . . 0.0 110.6 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.01 -25.41 81.44 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.719 1.378 . . . . 0.0 110.777 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -68.69 -24.13 64.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 109.768 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -101.19 2.59 40.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.455 -0.778 . . . . 0.0 110.427 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -94.35 141.95 27.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.234 -0.916 . . . . 0.0 110.473 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.36 131.77 45.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.529 -0.732 . . . . 0.0 109.801 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.854 HD12 HG23 ' B' ' 23' ' ' ILE . 18.2 mt -104.62 120.86 42.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.349 -0.844 . . . . 0.0 110.467 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.801 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.08 133.01 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.496 -0.753 . . . . 0.0 109.65 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.532 ' HB2' HD23 ' B' ' 67' ' ' LEU . 40.1 t80 -140.65 150.66 43.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.416 -0.803 . . . . 0.0 110.16 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.68 0.46 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.457 -0.777 . . . . 0.0 111.217 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.466 ' HA2' HD23 ' A' ' 26' ' ' LEU . . . 77.51 2.48 80.27 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -110.97 137.46 48.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.968 -1.313 . . . . 0.0 110.239 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.49 134.35 37.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.397 -0.814 . . . . 0.0 109.688 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.809 HD12 ' HB3' ' B' ' 43' ' ' LEU . 31.9 mt -83.8 141.04 31.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.232 -0.917 . . . . 0.0 110.306 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -93.49 129.32 39.73 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.358 -0.839 . . . . 0.0 110.524 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 73.1 m-20 -48.29 -26.11 1.86 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.734 . . . . 0.0 111.229 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.78 -9.31 84.72 Favored Glycine 0 N--CA 1.493 2.482 0 C-N-CA 120.139 -1.029 . . . . 0.0 110.553 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -99.35 156.8 16.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.994 -1.297 . . . . 0.0 110.483 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 31.8 p -102.38 167.65 9.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 110.181 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.604 ' HA ' HD12 ' B' ' 61' ' ' ILE . 86.6 mt -53.69 -47.02 70.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.255 -0.903 . . . . 0.0 110.629 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.76 -34.71 67.85 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.368 -0.833 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.63 -29.46 68.03 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.152 -0.967 . . . . 0.0 110.384 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.636 ' CG ' HD22 ' B' ' 50' ' ' LEU . 47.3 m-85 -101.24 28.97 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.835 . . . . 0.0 109.867 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.69 28.43 3.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.593 -0.692 . . . . 0.0 110.785 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.604 HD12 ' HA ' ' B' ' 56' ' ' LEU . 97.4 mt -81.36 108.54 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 109.741 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -105.73 173.53 6.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.379 -0.826 . . . . 0.0 110.366 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.4 OUTLIER -46.55 152.36 0.47 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.526 -0.734 . . . . 0.0 110.933 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.6 mm-40 62.97 15.87 8.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.701 -0.624 . . . . 0.0 110.59 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 144.93 49.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 0.0 110.079 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -107.56 106.83 17.38 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.33 -0.856 . . . . 0.0 109.929 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.532 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.4 mt -102.57 160.49 14.52 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.448 ' NE2' HG12 ' A' ' 28' ' ' VAL . 60.6 m80 -108.88 135.91 49.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -0.885 . . . . 0.0 109.936 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.2 tp -107.13 131.65 53.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.291 -0.881 . . . . 0.0 110.411 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.435 ' CG1' ' HB3' ' A' ' 21' ' ' GLU . 19.4 t -125.09 149.27 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.395 -0.816 . . . . 0.0 110.121 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 26.7 mt -94.69 91.47 6.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.411 -0.806 . . . . 0.0 110.278 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 71.17 3.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.353 -0.842 . . . . 0.0 110.24 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.14 160.63 2.8 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.298 -0.876 . . . . 0.0 110.391 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.36 89.2 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.326 -0.859 . . . . 0.0 110.409 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -132.6 -111.41 1.3 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.989 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.194 0.521 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -167.53 -168.54 1.05 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.84 23.22 14.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.457 -0.777 . . . . 0.0 109.526 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.63 -24.77 49.0 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER 54.3 57.64 5.68 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.384 -1.068 . . . . 0.0 110.34 -179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.1 84.94 0.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.709 -1.357 . . . . 0.0 109.709 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.3 72.12 0.42 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.321 -1.105 . . . . 0.0 110.534 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.8 t -165.55 -53.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.408 -0.807 . . . . 0.0 109.938 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -68.06 -26.88 66.08 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.409 -0.807 . . . . 0.0 110.12 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.561 ' HA ' HG11 ' A' ' 14' ' ' VAL . 22.8 m-85 -101.67 42.66 1.11 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.359 -0.838 . . . . 0.0 110.228 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -146.14 34.15 0.99 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.409 -0.807 . . . . 0.0 109.981 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -163.43 40.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.403 -0.811 . . . . 0.0 110.054 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 162.3 -29.88 0.28 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.561 HG11 ' HA ' ' A' ' 10' ' ' PHE . 9.8 p -96.86 -23.47 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.419 -1.048 . . . . 0.0 110.223 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.74 171.77 0.15 Allowed Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.489 -0.757 . . . . 0.0 110.444 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.95 -22.71 26.27 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 O-C-N 123.86 1.452 . . . . 0.0 110.616 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -66.68 -14.53 62.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.279 -0.888 . . . . 0.0 110.455 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.73 -34.25 30.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.282 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -169.49 118.67 0.57 Allowed Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.36 -0.837 . . . . 0.0 110.063 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.39 -14.69 34.34 Favored 'Trans proline' 0 C--N 1.306 -1.658 0 O-C-N 123.984 1.518 . . . . 0.0 109.989 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.536 ' HB3' HG11 ' B' ' 70' ' ' VAL . 7.5 mt-10 -73.95 -31.14 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.261 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.92 -31.11 23.83 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.82 77.86 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.5 -0.75 . . . . 0.0 109.438 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.641 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -79.75 -35.96 38.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.453 -0.78 . . . . 0.0 109.664 179.47 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.503 ' CB ' HD12 ' B' ' 44' ' ' ILE . . . -77.67 -31.89 52.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.422 -0.798 . . . . 0.0 110.038 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -78.03 -21.52 50.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.436 -0.79 . . . . 0.0 110.178 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.37 -35.52 30.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 108.96 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 24' ' ' LEU . 89.6 t -71.41 -31.15 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.62 -0.675 . . . . 0.0 109.53 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -72.94 -41.29 64.63 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.469 -0.77 . . . . 0.0 109.915 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 mtt -62.77 -31.06 71.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.426 -0.796 . . . . 0.0 109.928 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -31.6 62.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 110.016 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -43.92 46.24 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.413 -0.804 . . . . 0.0 110.014 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -45.39 90.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.054 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.59 -35.69 80.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.381 -0.825 . . . . 0.0 110.056 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -54.89 41.72 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.37 -0.831 . . . . 0.0 110.268 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mtt-85 -62.63 -48.5 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.5 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 8.8 mt-30 -63.0 -27.16 69.23 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.336 -0.853 . . . . 0.0 110.191 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -76.67 -53.41 8.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.487 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -55.15 -33.78 63.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 108.977 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.39 -35.54 23.06 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.722 -0.612 . . . . 0.0 109.571 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -71.15 -55.91 7.18 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.762 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -56.5 -43.53 79.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.512 -0.743 . . . . 0.0 110.229 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.6 ttm180 -54.78 -43.03 72.46 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.3 -0.875 . . . . 0.0 109.906 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.07 -27.59 57.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.448 -0.783 . . . . 0.0 109.785 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.97 -27.12 54.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.431 -0.793 . . . . 0.0 110.081 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.67 -45.3 19.28 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 110.032 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -29.13 66.63 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.158 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -83.35 -34.8 25.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.366 -0.834 . . . . 0.0 110.193 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.56 -38.75 74.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.074 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.22 -15.31 60.06 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.357 -0.84 . . . . 0.0 110.327 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -103.87 -42.42 5.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.243 -0.911 . . . . 0.0 110.374 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.31 29.7 5.99 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.301 -0.874 . . . . 0.0 110.381 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -110.88 -61.72 0.49 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 54' ' ' ILE . 5.1 mp -100.61 -15.94 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -1.103 . . . . 0.0 110.447 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.438 ' O ' HG23 ' A' ' 56' ' ' THR . . . -66.12 80.86 0.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.172 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 55' ' ' ALA . 0.8 OUTLIER -153.62 67.14 0.76 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 57' ' ' THR . 6.4 t -144.53 96.75 2.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.16 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.74 -120.44 0.53 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.8 t -167.48 46.31 0.05 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.461 -1.023 . . . . 0.0 110.266 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -101.25 48.68 0.89 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.333 -0.854 . . . . 0.0 110.127 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.58 -46.6 30.92 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.407 -0.808 . . . . 0.0 110.254 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.76 70.52 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 110.17 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -77.36 -51.26 11.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.38 -32.48 58.59 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.205 -0.934 . . . . 0.0 109.21 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.69 80.86 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 108.901 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mp -70.16 -30.68 67.88 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.648 ' O ' HD13 ' A' ' 67' ' ' LEU . 3.1 tm? -73.87 -42.95 60.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.453 -0.779 . . . . 0.0 109.46 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -80.41 -53.25 6.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.424 -0.797 . . . . 0.0 110.599 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -53.77 -38.51 64.51 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.109 -0.995 . . . . 0.0 110.623 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 47.3 m -70.31 -41.36 73.4 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.264 -0.898 . . . . 0.0 110.494 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.446 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.8 tp -84.34 -14.55 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.173 -0.954 . . . . 0.0 110.368 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -75.66 -44.67 41.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.284 -0.885 . . . . 0.0 109.658 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -79.06 -27.04 43.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.483 -0.761 . . . . 0.0 109.967 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -81.97 -49.04 10.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.359 -0.838 . . . . 0.0 110.229 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.75 -37.87 83.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.223 -0.923 . . . . 0.0 110.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -98.44 102.25 13.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.354 -0.841 . . . . 0.0 110.015 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -142.31 88.97 0.18 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.3 100.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.36 -1.083 . . . . 0.0 110.419 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.3 m -127.44 44.43 2.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.172 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.02 24.39 32.49 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.739 -1.345 . . . . 0.0 109.739 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.74 149.78 1.31 Allowed Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.274 -1.133 . . . . 0.0 108.967 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -72.17 63.18 3.43 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 123.556 1.292 . . . . 0.0 110.363 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -70.0 134.73 48.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.433 -0.792 . . . . 0.0 110.358 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.2 mt -117.42 -39.41 3.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.395 -0.816 . . . . 0.0 110.045 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 m -75.5 -2.66 29.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.416 -0.802 . . . . 0.0 110.683 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -109.27 12.2 24.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.005 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.425 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 3.9 mtt -111.36 -159.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -0.877 . . . . 0.0 109.952 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p -137.79 -171.78 3.08 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.27 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.58 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.5 pt-20 -66.07 -33.55 76.04 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.445 -0.784 . . . . 0.0 109.456 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.431 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 29.2 mt-10 -85.2 -39.73 17.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.662 -0.649 . . . . 0.0 109.543 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.12 -41.67 90.21 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 87' ' ' MET . 74.0 mt-30 -69.98 -34.63 73.61 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.58 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -58.76 -34.97 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.71 61.88 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.57 -0.706 . . . . 0.0 109.519 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.71 -34.12 77.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.519 -0.738 . . . . 0.0 109.943 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.77 -37.2 41.64 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.411 -0.805 . . . . 0.0 110.071 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.7 tpp -81.15 -25.95 36.46 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.286 -0.884 . . . . 0.0 109.79 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -71.97 -56.41 5.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.414 -0.804 . . . . 0.0 109.82 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 27.3 mtm -62.99 -27.21 69.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.491 -0.756 . . . . 0.0 109.97 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.3 t -74.22 -28.63 61.34 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.031 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.3 mp -109.81 21.57 16.73 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.427 -0.796 . . . . 0.0 110.192 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -107.05 -38.92 5.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.282 -0.886 . . . . 0.0 110.27 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -163.06 102.15 0.2 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -159.83 108.02 1.73 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.381 -1.07 . . . . 0.0 110.33 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.16 -14.45 14.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.308 -0.87 . . . . 0.0 110.453 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -25.48 66.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.187 -0.945 . . . . 0.0 110.081 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.95 97.6 0.16 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.75 77.89 1.79 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.317 -1.108 . . . . 0.0 110.157 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -135.17 61.38 1.67 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.371 -0.83 . . . . 0.0 110.237 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.23 38.51 2.73 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.355 -0.841 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.8 p -140.4 -65.75 0.45 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.288 -0.882 . . . . 0.0 110.266 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.191 -179.989 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.458 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 39.3 ttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.339 0.59 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -120.44 139.17 53.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.486 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.529 HD13 HG21 ' B' ' 17' ' ' VAL . 45.0 pt -137.55 158.33 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.223 -0.923 . . . . 0.0 110.514 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -111.78 145.56 39.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.608 -0.683 . . . . 0.0 110.297 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' B' ' 12' ' ' THR . 60.7 t -128.18 122.63 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.373 -0.829 . . . . 0.0 109.844 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.434 ' HG3' HG23 ' B' ' 12' ' ' THR . 0.1 OUTLIER -100.13 135.9 40.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.358 -0.839 . . . . 0.0 110.182 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.2 p -95.67 171.52 8.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.39 -0.819 . . . . 0.0 110.583 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.477 HD21 HG22 ' B' ' 70' ' ' VAL . 4.5 mm? -61.26 -13.28 17.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.506 -0.746 . . . . 0.0 111.192 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 75.8 p -95.44 -21.06 18.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.119 -0.988 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.89 9.2 14.16 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.941 -1.123 . . . . 0.0 110.394 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 131.76 34.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.071 -1.252 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.434 HG23 ' HG3' ' B' ' 6' ' ' LYS . 1.8 m -113.02 122.24 47.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.121 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mt -109.11 137.0 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.401 -0.812 . . . . 0.0 110.335 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.1 m -102.11 122.14 43.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.516 HD11 HG12 ' B' ' 30' ' ' ILE . 82.5 mt -123.44 161.45 24.78 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.171 -0.955 . . . . 0.0 110.806 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -106.25 116.12 31.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.534 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.529 HG21 HD13 ' B' ' 3' ' ' ILE . 34.9 m -140.03 179.12 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.336 -0.853 . . . . 0.0 110.627 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.569 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.4 mp0 -113.12 165.18 13.75 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.495 -0.753 . . . . 0.0 109.29 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.51 -27.59 15.49 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.593 1.312 . . . . 0.0 110.338 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.44 -2.34 57.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.214 -0.928 . . . . 0.0 110.494 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -71.21 143.27 50.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.23 -0.919 . . . . 0.0 110.44 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 82.5 p -83.22 160.33 21.8 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.513 -0.742 . . . . 0.0 110.261 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.435 HG13 ' HB3' ' B' ' 50' ' ' LEU . 48.4 mm -59.83 -38.16 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.41 -33.43 72.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 109.365 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -70.32 -35.27 73.54 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.537 -0.727 . . . . 0.0 109.217 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.65 -37.17 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.458 -0.776 . . . . 0.0 108.926 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -63.08 -42.16 99.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.445 -0.784 . . . . 0.0 108.922 178.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.19 75.1 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.606 -0.684 . . . . 0.0 109.325 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.496 ' HE3' HG12 ' B' ' 17' ' ' VAL . 14.4 mttt -68.35 -38.55 81.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.464 -0.773 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.516 HG12 HD11 ' B' ' 15' ' ' LEU . 10.9 mt -67.26 -40.93 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 109.223 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -48.68 80.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.421 -0.8 . . . . 0.0 109.497 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.89 -28.03 63.84 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.505 -0.747 . . . . 0.0 110.206 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -83.53 -42.66 16.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 110.146 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -108.33 -118.18 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.444 -0.785 . . . . 0.0 109.743 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.8 23.93 0.22 Allowed Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.783 -1.199 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.458 HG23 ' HD2' ' B' ' 37' ' ' PRO . 81.7 mt -91.88 142.2 26.26 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.205 -1.173 . . . . 0.0 110.21 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -69.48 134.15 27.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.698 1.367 . . . . 0.0 110.269 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.74 -26.32 82.77 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.717 1.377 . . . . 0.0 110.84 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.79 -24.98 64.48 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.305 -0.872 . . . . 0.0 109.941 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 30.9 mt-30 -101.27 7.38 42.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 110.514 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -94.38 138.05 32.8 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.483 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.415 ' C ' HD22 ' B' ' 43' ' ' LEU . 2.7 ttm180 -130.32 127.81 40.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.449 -0.782 . . . . 0.0 109.627 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD12 ' B' ' 50' ' ' LEU . 4.4 mm? -104.49 125.01 50.28 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.35 -0.844 . . . . 0.0 110.609 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.503 HD12 ' CB ' ' A' ' 25' ' ' ALA . 1.6 mt -122.25 141.11 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.566 -0.709 . . . . 0.0 110.31 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.664 ' HB3' HD21 ' B' ' 50' ' ' LEU . 47.1 t80 -141.65 148.2 38.76 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.25 0.3 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.511 -0.743 . . . . 0.0 111.482 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.21 1.99 90.27 Favored Glycine 0 N--CA 1.495 2.617 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.743 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -110.8 141.89 43.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.924 -1.339 . . . . 0.0 110.296 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -78.35 132.54 37.45 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 109.784 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.664 HD21 ' HB3' ' B' ' 45' ' ' PHE . 17.9 mt -84.05 142.79 30.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.232 -0.917 . . . . 0.0 110.08 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -93.45 132.75 37.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.358 -0.839 . . . . 0.0 110.406 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.41 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.42 -30.45 5.08 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.55 -0.719 . . . . 0.0 111.019 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.81 -2.66 90.67 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.54 153.73 18.81 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.101 -1.235 . . . . 0.0 110.343 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.8 p -102.19 164.18 11.83 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.85 . . . . 0.0 110.103 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.628 ' HA ' HD12 ' B' ' 61' ' ' ILE . 83.7 mt -53.58 -47.3 70.25 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.297 -0.877 . . . . 0.0 110.683 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 17.8 p -56.8 -36.04 69.45 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.396 -0.815 . . . . 0.0 111.214 -179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.44 -28.91 67.4 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.124 -0.985 . . . . 0.0 110.403 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.651 ' CD2' HD22 ' B' ' 50' ' ' LEU . 35.9 m-85 -101.19 28.32 5.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.419 -0.8 . . . . 0.0 109.908 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 50.77 28.45 3.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.596 -0.69 . . . . 0.0 110.669 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' B' ' 56' ' ' LEU . 92.4 mt -81.4 108.88 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.253 -0.904 . . . . 0.0 109.764 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -105.45 173.28 6.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.388 -0.82 . . . . 0.0 110.348 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.3 ptmt -46.76 152.77 0.45 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.504 -0.748 . . . . 0.0 111.085 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 63.17 14.98 8.17 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.805 -0.559 . . . . 0.0 111.012 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -71.5 145.25 49.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.012 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' THR . . . . . 0.402 ' C ' HD22 ' B' ' 67' ' ' LEU . 86.5 m -107.6 109.8 21.53 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.416 -0.803 . . . . 0.0 109.987 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.693 ' N ' HD22 ' B' ' 67' ' ' LEU . 2.9 mm? -102.47 160.53 14.47 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.309 -0.87 . . . . 0.0 110.134 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' B' ' 44' ' ' ILE . 9.1 m-70 -108.64 134.62 51.13 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.3 -0.875 . . . . 0.0 109.688 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.41 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 35.8 tp -107.15 127.57 53.62 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 110.129 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.536 HG11 ' HB3' ' A' ' 21' ' ' GLU . 44.2 t -124.87 165.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.435 -0.791 . . . . 0.0 110.02 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.42 ' N ' HG12 ' B' ' 70' ' ' VAL . 74.5 mt -93.94 109.44 21.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -84.67 117.32 23.71 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' B' ' 73' ' ' LEU . 7.8 mt -79.13 126.38 30.65 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.363 -0.836 . . . . 0.0 110.25 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -102.8 107.88 18.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.349 -0.845 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.94 -45.94 0.04 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 CA-C-O 117.979 -1.456 . . . . 0.0 109.552 -179.928 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.845 0 CA-C-O 121.201 0.524 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.592 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 3.2 tmm? -74.76 -17.74 60.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.592 ' CB ' ' O ' ' A' ' 2' ' ' MET . 0.2 OUTLIER 82.45 38.14 0.05 Allowed 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -179.031 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.51 -51.75 2.29 Favored Glycine 0 N--CA 1.482 1.755 0 N-CA-C 109.697 -1.361 . . . . 0.0 109.697 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.33 70.94 2.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.42 -1.047 . . . . 0.0 110.308 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -133.72 -64.82 0.07 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.45 22.42 1.32 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.371 -1.076 . . . . 0.0 110.354 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.42 -31.54 3.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 110.439 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -41.75 88.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.287 -0.883 . . . . 0.0 110.314 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.498 ' CE2' HG21 ' A' ' 14' ' ' VAL . 2.2 m-85 -93.3 87.09 5.51 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.449 -0.782 . . . . 0.0 110.182 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -114.28 63.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.44 -0.788 . . . . 0.0 109.919 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 58.48 25.67 13.3 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.341 -0.849 . . . . 0.0 110.176 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -100.94 -12.93 35.51 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.498 HG21 ' CE2' ' A' ' 10' ' ' PHE . 91.6 t -61.98 -67.36 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.283 -1.128 . . . . 0.0 110.129 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -137.42 163.08 51.31 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.344 -0.847 . . . . 0.0 110.436 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.73 -19.39 27.68 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 O-C-N 123.828 1.436 . . . . 0.0 110.67 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.5 t -67.93 -12.43 60.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.36 -20.22 60.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.197 -0.94 . . . . 0.0 110.551 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.588 ' CB ' HD12 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -169.51 121.2 0.62 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.175 -0.953 . . . . 0.0 109.829 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -69.7 -15.36 37.28 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 123.957 1.504 . . . . 0.0 110.234 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.487 ' OE2' HD12 ' B' ' 73' ' ' LEU . 0.3 OUTLIER -76.44 -31.64 57.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.839 . . . . 0.0 109.302 179.516 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.588 HD12 ' CB ' ' A' ' 19' ' ' ASP . 17.6 mt -85.32 -29.38 24.57 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.458 -0.776 . . . . 0.0 109.081 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.29 -32.62 68.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.545 -0.722 . . . . 0.0 109.295 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.68 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -82.39 -37.32 25.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.575 -0.703 . . . . 0.0 109.524 179.299 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.48 ' HB2' HG21 ' B' ' 70' ' ' VAL . . . -68.58 -35.5 77.46 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.375 -0.828 . . . . 0.0 109.87 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.727 ' O ' HD13 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -80.58 -23.54 39.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.454 -0.778 . . . . 0.0 110.137 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.53 -33.54 25.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.209 -0.932 . . . . 0.0 109.588 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 24' ' ' LEU . 88.6 t -75.86 -41.8 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.519 -0.738 . . . . 0.0 109.642 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 m -70.91 -40.11 72.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.61 -42.8 93.44 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.37 -0.831 . . . . 0.0 109.976 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -64.25 -32.1 73.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 109.913 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -64.42 -51.14 64.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.388 -0.82 . . . . 0.0 109.92 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -60.56 -36.38 78.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.388 -0.82 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -36.73 84.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.399 -0.813 . . . . 0.0 109.744 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -62.69 -43.73 98.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.422 -0.799 . . . . 0.0 109.831 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -70.11 -37.14 75.28 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.377 -0.827 . . . . 0.0 109.81 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -70.84 -26.56 63.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.5 -0.75 . . . . 0.0 109.933 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.39 -57.23 3.94 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.518 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.56 -31.65 37.07 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.371 -0.83 . . . . 0.0 109.023 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -85.33 -37.49 19.88 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -65.93 -55.79 15.08 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.752 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -61.93 -31.65 71.99 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.426 -0.797 . . . . 0.0 109.986 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -40.51 81.2 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.33 -0.856 . . . . 0.0 109.899 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -36.16 68.41 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 109.812 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.9 -31.15 71.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.465 -0.772 . . . . 0.0 109.919 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.69 -36.18 65.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.428 -0.795 . . . . 0.0 110.081 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.78 60.13 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.211 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -43.66 61.11 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.395 -0.815 . . . . 0.0 110.139 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.98 74.57 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.455 -0.778 . . . . 0.0 110.148 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.2 -25.81 55.5 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.78 -37.96 83.66 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.299 -0.875 . . . . 0.0 110.098 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -97.97 -28.4 13.81 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.838 . . . . 0.0 110.133 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.06 20.7 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.4 mm -107.77 90.42 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.391 -1.064 . . . . 0.0 109.999 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -151.63 76.47 1.2 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.862 . . . . 0.0 110.256 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -149.89 152.16 34.62 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.342 -0.849 . . . . 0.0 110.195 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.1 m -117.61 102.55 9.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.164 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.423 ' O ' HG23 ' A' ' 59' ' ' THR . . . -140.05 -91.35 0.2 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 58' ' ' GLY . 0.4 OUTLIER -155.26 75.26 0.94 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.374 -1.074 . . . . 0.0 110.214 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -133.29 85.45 2.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.283 -0.885 . . . . 0.0 110.244 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.25 -42.84 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.382 -0.824 . . . . 0.0 110.228 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.42 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.3 OUTLIER -125.08 76.13 1.51 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.339 -0.851 . . . . 0.0 110.074 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -76.66 -40.0 50.4 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.356 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -78.52 -32.28 47.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.212 -0.93 . . . . 0.0 109.131 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -60.79 -44.67 96.51 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.823 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.43 -29.56 70.61 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.45 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.2 tt -75.49 -37.92 59.85 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.518 -0.739 . . . . 0.0 109.785 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -82.81 -55.43 4.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 110.476 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 ttt -52.87 -41.61 64.47 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 110.687 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 83.7 m -69.01 -40.85 78.43 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.315 -0.866 . . . . 0.0 110.508 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 68' ' ' LYS . 4.1 tp -80.07 -18.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.959 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.93 -38.24 69.89 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.324 -0.86 . . . . 0.0 109.535 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -79.21 -31.78 43.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.461 -0.775 . . . . 0.0 109.673 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -80.13 -51.54 8.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.451 -0.781 . . . . 0.0 109.865 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.28 -23.69 66.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.371 -0.831 . . . . 0.0 110.122 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.4 107.22 0.17 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.332 -0.855 . . . . 0.0 110.497 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.26 -49.85 0.24 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.391 -1.483 . . . . 0.0 109.391 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -105.33 113.52 27.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.466 -1.02 . . . . 0.0 109.989 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -140.28 34.3 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.29 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.502 ' C ' HD12 ' A' ' 81' ' ' LEU . . . -100.69 34.84 5.27 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 80' ' ' GLY . 0.4 OUTLIER -160.22 145.16 11.02 Favored Pre-proline 0 N--CA 1.485 1.318 0 O-C-N 121.428 -1.042 . . . . 0.0 108.723 179.782 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -76.0 38.49 0.59 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.455 1.239 . . . . 0.0 110.762 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 50.4 91.81 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.179 -0.95 . . . . 0.0 110.701 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.619 HD13 ' O ' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -96.51 -24.79 15.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.357 -0.839 . . . . 0.0 110.202 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.41 -27.72 67.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.313 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.4 t -91.2 -24.85 19.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.311 -0.868 . . . . 0.0 110.324 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.408 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 32.0 mtt -67.41 117.53 9.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.402 -0.811 . . . . 0.0 110.324 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.2 p -79.37 -163.33 0.49 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.408 -0.807 . . . . 0.0 110.377 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.53 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 9.6 pt-20 -67.71 -32.23 72.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.468 -0.77 . . . . 0.0 109.258 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 32.7 mt-10 -85.35 -39.74 17.3 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.81 -44.78 92.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.469 ' CD ' HD11 ' A' ' 84' ' ' LEU . 59.3 mt-30 -66.13 -35.7 81.19 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.37 -33.79 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 178.856 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.76 -48.64 78.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 109.875 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -38.52 65.62 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.42 -0.8 . . . . 0.0 109.698 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.2 -37.89 86.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.446 -0.784 . . . . 0.0 109.992 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.5 ttm -80.66 -26.96 37.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.357 -0.839 . . . . 0.0 109.704 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -33.57 75.91 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.498 -0.751 . . . . 0.0 109.877 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.7 mtt -86.27 -28.92 23.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 110.097 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -28.89 55.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.405 -0.809 . . . . 0.0 110.148 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.8 tp -85.16 5.33 30.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -65.38 -29.33 70.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.23 -0.919 . . . . 0.0 110.244 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.1 121.51 3.1 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -92.63 78.99 4.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.409 -1.054 . . . . 0.0 110.227 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -65.42 -44.26 87.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -91.08 -67.53 0.85 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.312 -0.868 . . . . 0.0 110.185 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.11 -58.09 5.02 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -82.36 67.07 8.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.322 -1.105 . . . . 0.0 110.184 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.32 42.84 2.31 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.378 -0.826 . . . . 0.0 110.171 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -73.87 -34.96 64.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.406 -0.809 . . . . 0.0 110.152 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 t -105.69 41.66 1.35 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.21 -179.993 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.6 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.164 0.507 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -90.51 139.45 30.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.439 -0.788 . . . . 0.0 109.843 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -137.25 158.43 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.264 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.77 145.11 39.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.646 . . . . 0.0 110.671 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.7 t -128.03 119.44 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 109.53 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.0 mtmp? -100.26 129.85 46.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.361 -0.837 . . . . 0.0 110.686 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.2 p -96.4 174.81 6.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.437 -0.79 . . . . 0.0 110.067 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mt -61.62 -13.56 23.21 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.312 -0.868 . . . . 0.0 110.841 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 79.0 p -95.57 19.02 11.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.106 -0.997 . . . . 0.0 110.565 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.88 11.57 58.24 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.2 OUTLIER -84.84 128.28 34.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.068 -1.254 . . . . 0.0 109.952 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.4 m -113.09 124.43 52.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.883 . . . . 0.0 110.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mt -109.14 136.88 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.48 -0.762 . . . . 0.0 110.288 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 12.0 m -102.29 120.78 41.06 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.529 -0.732 . . . . 0.0 109.502 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 69.8 mt -123.38 162.93 21.8 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 110.963 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.3 115.71 30.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.537 -0.727 . . . . 0.0 109.347 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.25 174.85 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.285 -0.885 . . . . 0.0 110.863 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.453 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.5 mm-40 -113.14 165.5 13.08 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.41 -24.98 22.01 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 123.507 1.267 . . . . 0.0 110.385 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.0 p -84.6 -4.62 59.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 110.474 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -71.26 139.11 49.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.175 -0.953 . . . . 0.0 110.683 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 57.6 p -83.67 160.21 21.38 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.51 -0.744 . . . . 0.0 110.495 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.892 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.48 -34.88 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.346 -0.846 . . . . 0.0 109.705 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.31 -37.26 80.02 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.371 -0.83 . . . . 0.0 109.386 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -31.48 68.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.463 -0.773 . . . . 0.0 109.203 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' VAL . . . . . 0.408 HG23 ' O ' ' B' ' 22' ' ' THR . 58.1 t -69.92 -41.64 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.515 -0.741 . . . . 0.0 109.078 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.62 ' HD2' HG22 ' B' ' 23' ' ' ILE . 4.4 mttp -62.88 -38.95 92.94 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.437 -0.789 . . . . 0.0 108.947 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.79 -36.18 80.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.488 -0.757 . . . . 0.0 109.346 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.42 ' HD3' HG12 ' B' ' 17' ' ' VAL . 7.0 mttm -68.28 -39.7 82.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.603 HD13 HD22 ' B' ' 69' ' ' LEU . 12.5 mt -66.92 -38.87 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.211 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.67 -50.63 72.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.476 -0.765 . . . . 0.0 109.578 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.87 -26.42 62.09 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.401 -0.812 . . . . 0.0 110.236 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -84.27 -40.46 17.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.807 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.99 -55.54 2.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.441 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.19 17.76 1.96 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.522 HG23 ' HD2' ' B' ' 37' ' ' PRO . 81.1 mt -91.45 144.52 29.78 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.157 -1.202 . . . . 0.0 109.791 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.522 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.9 Cg_endo -70.13 133.48 24.99 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.552 1.291 . . . . 0.0 110.417 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.97 -27.48 84.85 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.736 1.387 . . . . 0.0 111.046 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.83 -22.39 64.24 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.396 -0.815 . . . . 0.0 110.336 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 41.9 mm-40 -101.29 -2.29 31.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.313 -0.867 . . . . 0.0 110.646 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -94.35 143.42 26.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.215 -0.928 . . . . 0.0 110.397 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.517 ' NH1' HD21 ' A' ' 22' ' ' LEU . 2.9 mtt180 -130.09 132.19 46.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.942 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.892 HD12 HG23 ' B' ' 23' ' ' ILE . 20.1 mt -104.74 119.54 39.25 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.355 -0.84 . . . . 0.0 110.369 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.792 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.17 134.71 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.503 -0.748 . . . . 0.0 109.907 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.51 ' HB2' HD23 ' B' ' 67' ' ' LEU . 37.2 t80 -141.49 154.53 45.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.548 -0.72 . . . . 0.0 110.007 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.431 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.1 25.56 0.18 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.539 -0.725 . . . . 0.0 111.513 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.34 -4.93 75.14 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.777 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.77 142.84 42.21 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.04 -1.271 . . . . 0.0 110.47 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.71 138.4 38.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.351 -0.843 . . . . 0.0 109.779 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.744 HD12 ' HB3' ' B' ' 43' ' ' LEU . 40.7 mt -84.3 148.4 26.69 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.304 -0.872 . . . . 0.0 109.998 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -93.51 125.95 38.4 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.327 -0.858 . . . . 0.0 110.394 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -48.54 -32.49 8.08 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.362 -0.836 . . . . 0.0 110.984 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.69 -1.85 90.58 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 31.9 mmt-85 -99.57 157.88 16.14 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.066 -1.255 . . . . 0.0 110.29 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.5 p -102.55 162.22 13.09 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.591 ' HA ' HD12 ' B' ' 61' ' ' ILE . 93.7 mt -53.37 -45.38 69.17 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.279 -0.888 . . . . 0.0 110.649 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.87 -36.7 70.38 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.085 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.63 -27.69 66.56 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.187 -0.946 . . . . 0.0 110.361 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.48 ' CD2' HD22 ' B' ' 50' ' ' LEU . 36.9 m-85 -101.09 27.59 5.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.348 -0.845 . . . . 0.0 109.931 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 50.88 28.03 3.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.464 -0.773 . . . . 0.0 110.716 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' B' ' 56' ' ' LEU . 85.9 mt -81.43 112.04 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.349 -0.845 . . . . 0.0 109.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.63 173.02 6.49 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.38 -0.825 . . . . 0.0 110.448 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.8 pttm -46.65 154.16 0.33 Allowed 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.492 0.663 . . . . 0.0 111.177 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.4 mt-10 62.58 15.61 8.09 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.749 -0.594 . . . . 0.0 110.805 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 141.57 49.9 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.179 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.8 m -107.61 110.63 22.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.292 -0.88 . . . . 0.0 109.945 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.51 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.2 mt -102.76 161.47 13.71 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.313 -0.867 . . . . 0.0 110.008 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -108.8 131.64 54.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.306 -0.871 . . . . 0.0 109.951 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.603 HD22 HD13 ' B' ' 30' ' ' ILE . 61.9 tp -106.98 133.85 51.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.217 -0.927 . . . . 0.0 110.551 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.48 HG21 ' HB2' ' A' ' 25' ' ' ALA . 45.1 t -124.96 154.39 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.35 -0.844 . . . . 0.0 110.205 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 43.4 mt -94.4 89.39 5.85 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.394 -0.817 . . . . 0.0 110.288 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -73.84 142.36 46.11 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.179 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.487 HD12 ' OE2' ' A' ' 21' ' ' GLU . 1.1 mt -125.53 -170.82 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.353 -0.842 . . . . 0.0 110.211 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -74.17 116.69 15.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.375 -0.828 . . . . 0.0 110.203 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.92 -31.5 35.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.869 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.9 t60 . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.171 0.51 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.573 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -77.94 -41.46 36.24 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 2' ' ' MET . 5.1 tp 80.91 39.45 0.07 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.69 -39.72 77.2 Favored Glycine 0 N--CA 1.481 1.689 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 52.39 89.82 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.343 -1.092 . . . . 0.0 110.426 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.26 -169.99 12.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.29 35.96 1.4 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.39 -1.065 . . . . 0.0 110.158 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.02 -37.02 2.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.372 -0.83 . . . . 0.0 110.345 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -55.69 -44.7 77.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.234 -0.916 . . . . 0.0 110.32 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -115.56 93.55 4.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.362 -0.836 . . . . 0.0 109.976 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.94 52.98 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.319 -0.863 . . . . 0.0 110.389 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 51.92 29.06 5.67 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.334 -0.854 . . . . 0.0 110.434 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -126.33 32.39 3.76 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.508 HG23 ' N ' ' A' ' 15' ' ' ASP . 34.9 m -139.9 -41.1 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.355 -1.085 . . . . 0.0 110.463 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 17' ' ' SER . 28.9 p30 -139.26 163.87 42.79 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.201 -0.937 . . . . 0.0 109.826 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.495 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 35.3 Cg_endo -57.89 72.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.879 1.462 . . . . 0.0 111.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.2 p 63.2 33.42 14.32 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.585 0.707 . . . . 0.0 109.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 17' ' ' SER . . . 38.15 33.78 0.06 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.266 0.555 . . . . 0.0 111.264 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.84 118.47 0.54 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.45 -0.782 . . . . 0.0 109.884 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.44 -14.95 34.44 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 O-C-N 123.937 1.493 . . . . 0.0 110.199 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 22' ' ' LEU . 9.9 pt-20 -76.57 -28.48 56.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.349 -0.845 . . . . 0.0 109.692 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.43 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 29.2 mt -90.59 -27.01 19.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.499 -0.75 . . . . 0.0 109.558 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.495 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -71.33 -35.03 71.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.366 -0.834 . . . . 0.0 109.648 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.644 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.2 mt -84.37 -31.23 24.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.358 -0.839 . . . . 0.0 109.567 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.97 75.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.473 -0.767 . . . . 0.0 109.764 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp -83.28 -23.14 32.77 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -81.6 -31.15 32.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.275 -0.891 . . . . 0.0 109.393 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 24' ' ' LEU . 63.9 t -82.37 -25.33 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.613 -0.679 . . . . 0.0 109.814 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -80.03 -47.43 14.9 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 110.267 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 31.5 mtp -67.28 -31.09 71.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.413 -0.804 . . . . 0.0 110.281 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -73.04 -36.42 66.92 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.387 -0.821 . . . . 0.0 110.242 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -39.45 76.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.861 . . . . 0.0 110.017 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -66.35 -27.64 68.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.418 -0.801 . . . . 0.0 110.086 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -75.1 -47.11 30.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.329 -0.857 . . . . 0.0 110.176 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -59.86 -25.94 65.45 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.278 -0.889 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -83.06 -48.05 11.01 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.336 -0.853 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.552 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.5 mm-40 -75.74 -21.95 57.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.384 -0.822 . . . . 0.0 110.373 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -83.96 -57.4 3.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.294 -0.879 . . . . 0.0 109.73 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -52.58 -32.54 41.65 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.382 -0.824 . . . . 0.0 109.19 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -84.18 -36.63 22.7 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.598 -0.688 . . . . 0.0 109.673 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.53 -56.45 6.53 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.974 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -57.19 -42.52 81.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.47 -0.769 . . . . 0.0 110.384 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.6 ttm180 -57.23 -33.76 67.89 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.263 -0.898 . . . . 0.0 110.049 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.56 -27.87 61.56 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.379 -0.825 . . . . 0.0 109.826 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.63 -24.74 56.48 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.462 -0.774 . . . . 0.0 110.081 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.23 -44.96 11.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.337 -0.852 . . . . 0.0 110.205 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.64 -35.96 82.31 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.371 -0.83 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 t -77.68 -30.92 52.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.436 -0.79 . . . . 0.0 110.273 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.92 -32.32 61.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.219 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.78 -27.72 50.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 110.283 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -68.25 -27.7 66.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.286 -0.884 . . . . 0.0 110.286 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.09 -28.16 15.23 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.246 -0.909 . . . . 0.0 110.263 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -92.76 -49.85 2.63 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.0 mm -117.18 96.71 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.323 -1.104 . . . . 0.0 110.159 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -167.88 -62.94 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.459 -0.775 . . . . 0.0 110.258 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.2 p -121.19 108.59 13.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 110.199 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.4 m -133.85 -53.96 0.87 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.247 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.93 50.96 0.27 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.0 m -130.08 102.39 6.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.382 -1.069 . . . . 0.0 110.268 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -132.21 61.26 1.66 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 110.244 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.26 -34.57 11.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.39 -0.818 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.51 75.9 1.15 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.329 -0.857 . . . . 0.0 110.23 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -59.14 2.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 110.191 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -74.77 -27.5 60.36 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.215 -0.928 . . . . 0.0 109.175 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -43.84 97.88 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.874 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.95 -29.15 69.5 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -77.42 -36.84 52.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.529 -0.732 . . . . 0.0 109.866 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.3 -54.77 4.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.399 -0.813 . . . . 0.0 110.499 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.7 mmt -54.44 -43.05 71.25 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.148 -0.97 . . . . 0.0 110.627 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.5 m -69.62 -40.4 76.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.272 -0.892 . . . . 0.0 110.621 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.409 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.0 tp -82.17 -15.96 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.154 -0.966 . . . . 0.0 110.221 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 68' ' ' LYS . 27.5 t -74.77 -42.89 57.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.876 . . . . 0.0 109.791 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -79.25 -27.02 42.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.528 -0.733 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -83.14 -50.16 8.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.389 -0.819 . . . . 0.0 110.017 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.59 -33.35 72.6 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.372 -0.83 . . . . 0.0 110.049 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -63.63 -31.01 72.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.429 -0.794 . . . . 0.0 110.25 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.34 -27.96 71.55 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 132.95 40.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.344 -1.092 . . . . 0.0 110.263 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.8 m -151.28 27.36 0.68 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.292 -0.88 . . . . 0.0 110.181 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -88.35 54.78 4.21 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.0 149.2 1.46 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.425 -1.044 . . . . 0.0 108.856 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -71.03 64.64 2.56 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.59 1.31 . . . . 0.0 110.29 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -56.4 111.01 0.87 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.481 -0.762 . . . . 0.0 110.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 mt -80.05 -26.3 39.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.409 -0.807 . . . . 0.0 110.286 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.4 p -68.0 -15.66 63.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.312 -0.867 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.9 m -118.2 22.06 12.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 110.09 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.4 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 43.2 mtt -128.88 123.4 32.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.393 -0.817 . . . . 0.0 109.98 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.8 p -77.5 -163.08 0.35 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.423 -0.798 . . . . 0.0 110.401 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.3 pt-20 -68.52 -31.68 71.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.521 -0.737 . . . . 0.0 109.196 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.4 mt-10 -85.57 -40.04 16.72 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.25 -44.73 94.32 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.4 ' HG3' ' HB3' ' A' ' 87' ' ' MET . 70.3 mt-30 -67.35 -34.18 76.78 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.078 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -66.38 -34.86 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.938 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.73 -46.0 90.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.514 -0.741 . . . . 0.0 110.238 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -40.19 29.87 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.367 -0.833 . . . . 0.0 109.949 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.91 79.21 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.349 -0.844 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 tpp -83.88 -24.39 30.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.361 -0.837 . . . . 0.0 110.097 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -28.62 66.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.298 -0.876 . . . . 0.0 110.228 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.8 mmm -93.96 -27.34 16.4 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.381 -0.824 . . . . 0.0 110.166 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -33.11 64.94 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.315 -0.866 . . . . 0.0 110.202 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.7 mt -72.08 -27.06 62.42 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.848 . . . . 0.0 110.206 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -104.91 14.0 30.19 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.37 -0.831 . . . . 0.0 110.489 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -138.7 78.81 0.3 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -84.08 79.34 9.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.377 -1.072 . . . . 0.0 110.176 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -101.75 -32.22 10.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.357 -0.839 . . . . 0.0 110.134 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.403 ' O ' ' CG ' ' A' ' 106' ' ' PHE . 59.2 t80 -113.84 35.65 4.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.357 -0.84 . . . . 0.0 110.157 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.12 133.58 36.64 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -83.42 64.59 7.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.3 -1.118 . . . . 0.0 110.177 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -92.49 -37.87 12.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.354 -0.841 . . . . 0.0 110.303 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.48 62.89 2.53 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.357 -0.839 . . . . 0.0 110.26 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.7 t -116.21 81.0 1.54 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.357 -0.84 . . . . 0.0 110.192 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.192 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.333 0.587 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -98.2 147.6 24.44 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.136 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.691 HD13 HG21 ' B' ' 17' ' ' VAL . 34.7 pt -137.63 157.72 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.334 -0.854 . . . . 0.0 110.076 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.41 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 80.5 m-85 -111.94 143.08 43.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.588 -0.695 . . . . 0.0 110.663 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' B' ' 12' ' ' THR . 95.7 t -127.83 119.74 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.49 -0.756 . . . . 0.0 109.455 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 18.7 mttt -100.08 136.75 39.5 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.409 -0.807 . . . . 0.0 110.743 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 73.4 p -96.17 171.13 8.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.437 -0.789 . . . . 0.0 110.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.82 -10.49 9.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.397 -0.814 . . . . 0.0 111.24 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.5 p -95.55 -18.49 20.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.933 -1.105 . . . . 0.0 110.631 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.99 7.4 25.23 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 9.5 tttt -84.61 129.87 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.083 -1.245 . . . . 0.0 109.811 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 7.5 m -113.14 126.1 55.07 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.232 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.4 mt -109.23 136.21 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.432 -0.792 . . . . 0.0 110.489 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.41 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 19.2 m -102.41 119.78 39.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.457 -0.777 . . . . 0.0 109.409 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.422 HD11 HG12 ' B' ' 30' ' ' ILE . 80.3 mt -123.51 166.85 14.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -106.52 114.31 28.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.804 . . . . 0.0 109.48 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.691 HG21 HD13 ' B' ' 3' ' ' ILE . 33.8 m -140.52 169.34 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 110.951 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.427 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.0 OUTLIER -112.61 165.12 13.72 Favored Pre-proline 0 N--CA 1.488 1.474 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.768 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -71.67 -24.73 21.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.466 1.245 . . . . 0.0 110.375 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.45 -5.67 59.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 110.531 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -71.24 143.48 50.4 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.265 -0.897 . . . . 0.0 110.721 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.4 p -83.3 159.52 21.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.588 -0.695 . . . . 0.0 110.391 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.585 HG23 HD12 ' B' ' 43' ' ' LEU . 43.5 mm -59.64 -36.33 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 109.647 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.83 -35.91 77.73 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 109.424 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -70.29 -33.15 71.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.538 -0.726 . . . . 0.0 109.393 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.1 t -70.15 -39.74 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.172 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -62.86 -43.49 98.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.475 -0.766 . . . . 0.0 109.166 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.35 -32.98 72.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.509 -0.744 . . . . 0.0 109.309 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.549 ' CD ' HG12 ' B' ' 17' ' ' VAL . 34.9 mttm -68.28 -39.36 82.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.479 -0.763 . . . . 0.0 109.473 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.422 HG12 HD11 ' B' ' 15' ' ' LEU . 10.2 mt -67.26 -38.69 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.369 -0.832 . . . . 0.0 109.09 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.5 OUTLIER -60.53 -50.67 72.64 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.491 179.108 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.19 -26.7 63.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.404 -0.81 . . . . 0.0 110.33 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.9 mmtm -83.85 -40.91 18.08 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.287 -0.883 . . . . 0.0 110.801 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -108.08 -55.57 2.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.244 -0.91 . . . . 0.0 110.449 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.36 18.59 1.82 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.479 HG23 ' HD2' ' B' ' 37' ' ' PRO . 18.3 mt -91.31 143.52 28.4 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.071 -1.252 . . . . 0.0 109.69 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.479 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -68.0 133.84 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 O-C-N 123.65 1.342 . . . . 0.0 110.387 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.91 -26.48 83.19 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.65 1.342 . . . . 0.0 110.756 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.0 64.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.325 -0.86 . . . . 0.0 110.061 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 23.1 mt-30 -101.23 -0.9 35.01 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.37 -0.831 . . . . 0.0 110.629 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -94.17 140.39 29.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.163 -0.96 . . . . 0.0 110.243 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -130.08 130.43 44.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.457 -0.777 . . . . 0.0 109.956 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.923 ' HB3' HD12 ' B' ' 50' ' ' LEU . 23.1 mt -104.59 116.91 32.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.404 -0.81 . . . . 0.0 110.441 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.782 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.7 mp -121.16 134.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.493 -0.754 . . . . 0.0 109.862 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.558 ' HB2' HD23 ' B' ' 67' ' ' LEU . 57.5 t80 -140.8 152.5 45.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.469 -0.77 . . . . 0.0 109.941 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.18 27.76 0.35 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.492 -0.755 . . . . 0.0 111.25 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.03 1.64 80.09 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -110.79 137.27 48.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.044 -1.268 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -78.6 135.72 37.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.358 -0.838 . . . . 0.0 109.9 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.923 HD12 ' HB3' ' B' ' 43' ' ' LEU . 51.3 mt -83.83 138.4 33.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.384 -0.822 . . . . 0.0 110.123 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -93.64 131.02 39.34 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 110.422 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 64.3 m-20 -48.34 -27.6 2.65 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.484 -0.76 . . . . 0.0 111.059 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -7.98 86.47 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.2 mmt-85 -99.36 155.87 17.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.007 -1.29 . . . . 0.0 110.442 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.9 p -102.51 163.47 12.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.419 -0.8 . . . . 0.0 110.185 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.556 ' HA ' HD12 ' B' ' 61' ' ' ILE . 98.0 mt -53.49 -44.48 69.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.338 -0.851 . . . . 0.0 110.635 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 60.0 p -56.94 -36.85 70.73 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.333 -0.854 . . . . 0.0 110.986 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.52 -27.68 66.4 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.173 -0.955 . . . . 0.0 110.257 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.665 ' CD2' HD22 ' B' ' 50' ' ' LEU . 58.2 m-85 -100.95 27.74 5.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -0.809 . . . . 0.0 109.803 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 m120 50.74 28.33 3.54 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.544 -0.723 . . . . 0.0 110.673 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.556 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.5 mt -81.56 108.64 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.403 -0.811 . . . . 0.0 109.96 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.65 173.35 6.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.358 -0.839 . . . . 0.0 110.197 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 4.4 pttt -46.6 152.71 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.462 -0.774 . . . . 0.0 110.958 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.5 mt-10 62.67 16.49 8.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.593 -0.692 . . . . 0.0 110.555 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.58 144.97 49.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.259 -0.901 . . . . 0.0 110.117 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.9 m -107.54 107.9 18.95 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.856 . . . . 0.0 109.919 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.558 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.3 mt -102.39 160.62 14.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.116 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -108.83 134.49 51.45 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.293 -0.88 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.8 tp -107.21 133.73 51.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.246 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 41.4 t -125.04 152.55 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.443 -0.786 . . . . 0.0 110.293 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mt -94.46 114.83 26.9 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.503 -0.748 . . . . 0.0 110.128 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.416 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 2.9 tmt_? -83.77 78.29 9.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.288 -0.883 . . . . 0.0 110.17 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -99.8 129.78 45.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.403 -0.811 . . . . 0.0 110.24 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -138.35 69.9 1.38 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.333 -0.854 . . . . 0.0 110.172 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 147.14 84.27 0.05 OUTLIER Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.011 -1.438 . . . . 0.0 109.621 -179.913 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.182 0.515 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.567 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -160.69 -65.31 0.06 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 110.198 -179.948 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.567 ' CB ' ' O ' ' A' ' 2' ' ' MET . 5.1 tp 80.66 39.93 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.91 60.73 3.78 Favored Glycine 0 N--CA 1.482 1.766 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -168.23 31.13 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.316 -1.109 . . . . 0.0 110.231 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.32 -55.28 0.26 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.59 26.95 9.5 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.362 -1.081 . . . . 0.0 110.159 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 75.6 m -129.42 17.85 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.412 -0.805 . . . . 0.0 110.4 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -103.42 -18.0 15.0 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.283 -0.885 . . . . 0.0 110.306 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE1' ' NH2' ' B' ' 72' ' ' ARG . 29.0 m-85 -101.68 -27.87 12.81 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.272 -0.893 . . . . 0.0 110.202 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.39 38.24 1.45 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.406 -0.808 . . . . 0.0 110.199 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.91 -44.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.372 -0.83 . . . . 0.0 110.164 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.94 -38.03 60.33 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 31.7 m -114.89 -27.54 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.346 -1.091 . . . . 0.0 110.313 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 58.85 173.01 0.05 OUTLIER Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.932 . . . . 0.0 109.945 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.91 -19.24 40.53 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 O-C-N 123.653 1.343 . . . . 0.0 110.412 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.0 t -73.62 -13.98 61.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.406 -0.808 . . . . 0.0 110.391 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 14' ' ' VAL . . . -92.82 -13.15 29.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.221 -0.924 . . . . 0.0 110.455 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.422 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 45.8 m-20 -147.79 110.49 3.84 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.894 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 19' ' ' ASP . 51.8 Cg_endo -71.22 -9.52 25.59 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.02 1.537 . . . . 0.0 110.631 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -79.49 -31.64 42.33 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 109.116 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.451 HD23 ' C ' ' A' ' 22' ' ' LEU . 4.3 tt -88.47 -28.21 20.99 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.531 -0.731 . . . . 0.0 109.346 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.672 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.2 mm? -82.36 -34.68 28.35 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 109.565 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.88 -32.49 74.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.374 -0.829 . . . . 0.0 109.7 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.869 ' O ' HD13 ' A' ' 26' ' ' LEU . 2.8 tm? -82.99 -25.67 32.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.484 -0.76 . . . . 0.0 110.064 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -84.43 -33.29 23.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.88 . . . . 0.0 109.642 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 24' ' ' LEU . 96.4 t -75.31 -30.84 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.554 -0.716 . . . . 0.0 109.788 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.1 m -77.6 -38.15 48.77 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.396 -0.815 . . . . 0.0 110.051 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.0 tpt -63.49 -46.55 85.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.442 -0.786 . . . . 0.0 110.005 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.84 -34.44 78.16 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.335 -0.853 . . . . 0.0 110.124 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.58 -45.81 88.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.276 -0.89 . . . . 0.0 109.959 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -62.04 -28.56 69.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.408 -0.807 . . . . 0.0 110.148 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -47.68 32.69 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.119 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.55 -47.11 80.16 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.474 -0.766 . . . . 0.0 110.134 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -49.47 75.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.365 -0.834 . . . . 0.0 110.101 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.584 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.5 mt-30 -69.42 -22.48 63.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.343 -0.848 . . . . 0.0 110.225 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.54 -57.43 3.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 109.666 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -52.36 -30.2 27.64 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.794 . . . . 0.0 109.202 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -88.03 -34.17 18.09 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.584 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -65.21 -47.52 76.6 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.358 -0.839 . . . . 0.0 109.729 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.524 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 21.5 ptt180 -70.53 -34.17 71.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.469 -0.769 . . . . 0.0 109.796 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mmt-85 -52.86 -42.8 65.57 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.39 -0.819 . . . . 0.0 109.219 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.9 -27.15 36.36 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.524 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -63.55 -28.51 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.562 -0.711 . . . . 0.0 109.739 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.67 -42.12 12.19 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.788 . . . . 0.0 110.049 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.09 -25.76 66.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.419 -0.8 . . . . 0.0 110.179 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.2 m -94.38 -32.62 13.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.346 -0.846 . . . . 0.0 110.236 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -67.92 -30.27 69.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.393 -0.817 . . . . 0.0 110.15 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.05 65.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.396 -0.815 . . . . 0.0 110.337 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -111.25 -34.69 6.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -0.882 . . . . 0.0 110.254 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -94.07 -37.29 11.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.354 -0.841 . . . . 0.0 110.213 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.36 -75.62 1.05 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 pt -125.84 -140.15 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.401 -1.058 . . . . 0.0 109.822 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.95 -175.5 4.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.091 -1.006 . . . . 0.0 110.21 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 m -143.46 151.23 40.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.411 -0.806 . . . . 0.0 110.209 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 57' ' ' THR . 5.2 t -143.34 82.77 1.76 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.377 -0.827 . . . . 0.0 110.16 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -134.64 27.79 3.18 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.6 m -106.86 55.38 0.66 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.344 -1.092 . . . . 0.0 110.139 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -83.74 80.59 9.08 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.56 -27.4 8.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.353 -0.842 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.22 77.74 1.66 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.822 . . . . 0.0 110.17 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.89 -53.04 7.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.369 -0.832 . . . . 0.0 110.229 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -74.34 -29.07 61.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.19 -0.944 . . . . 0.0 109.086 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.41 96.9 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.54 -0.864 . . . . 0.0 108.928 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 17.1 mt -64.73 -28.85 69.87 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.11 -47.54 28.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.522 -0.736 . . . . 0.0 109.842 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 -53.55 7.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.33 -0.856 . . . . 0.0 110.527 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -51.98 -39.6 59.59 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.177 -0.952 . . . . 0.0 110.714 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 34.3 m -69.2 -43.33 74.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.17 -12.65 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.136 -0.978 . . . . 0.0 110.332 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.53 -41.71 45.74 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.79 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -84.28 -23.02 30.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.416 -0.803 . . . . 0.0 110.249 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.47 -40.19 14.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.344 -0.848 . . . . 0.0 110.422 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -75.33 -29.57 60.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.197 -0.939 . . . . 0.0 110.243 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -59.53 109.72 0.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.354 -0.841 . . . . 0.0 110.186 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -146.56 -67.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -92.0 -28.92 16.9 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -1.131 . . . . 0.0 110.312 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.644 HG22 ' O ' ' A' ' 79' ' ' THR . 90.7 m 52.45 28.99 6.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.393 -0.817 . . . . 0.0 110.338 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.568 ' C ' HD23 ' A' ' 81' ' ' LEU . . . -92.73 24.88 21.68 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.568 HD23 ' C ' ' A' ' 80' ' ' GLY . 0.4 OUTLIER -173.08 147.38 1.5 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.244 -1.15 . . . . 0.0 108.902 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -75.56 38.75 0.58 Allowed 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.506 1.266 . . . . 0.0 110.719 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 50.15 76.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.228 -0.92 . . . . 0.0 110.553 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.2 mt -79.32 -27.87 42.13 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.372 -0.83 . . . . 0.0 110.333 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -25.7 62.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.283 -0.886 . . . . 0.0 110.288 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.0 p -83.86 -37.57 22.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.358 -0.839 . . . . 0.0 110.106 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 15.0 mtm -81.44 121.05 25.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.384 -0.822 . . . . 0.0 110.139 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.6 p -77.54 -164.55 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.304 -0.872 . . . . 0.0 110.426 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.563 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.5 pt-20 -67.61 -30.99 70.72 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.558 -0.713 . . . . 0.0 109.126 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 65.6 mt-10 -85.31 -40.67 16.3 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.75 -42.16 99.54 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -70.47 -35.62 73.41 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.33 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.808 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.23 96.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.484 -0.76 . . . . 0.0 109.624 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -74.05 -51.82 14.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.495 -0.753 . . . . 0.0 110.147 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.92 -37.65 80.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.453 -0.779 . . . . 0.0 110.358 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 tpt -81.57 -20.13 40.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.103 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -69.34 -30.56 68.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.088 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 69.7 mtp -95.42 -21.84 18.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.35 -0.844 . . . . 0.0 110.473 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.4 m -79.64 -37.56 35.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.261 -0.899 . . . . 0.0 110.418 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.98 -35.23 78.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.273 -0.892 . . . . 0.0 110.182 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -84.37 -64.44 1.16 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 116.68 -95.71 0.69 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.539 -1.425 . . . . 0.0 109.539 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -165.87 112.92 0.91 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.378 -1.072 . . . . 0.0 110.242 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -125.73 33.35 5.11 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.302 -0.874 . . . . 0.0 110.257 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -147.68 -62.76 0.27 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.73 55.28 1.16 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -129.82 -149.48 0.4 Allowed 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.376 -1.073 . . . . 0.0 109.617 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -89.33 0.59 56.7 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.381 -0.825 . . . . 0.0 110.595 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 51.97 61.51 3.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.519 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.8 m -153.84 113.82 3.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.381 -0.824 . . . . 0.0 110.216 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.184 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.313 0.578 . . . . 0.0 110.349 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -119.08 137.9 53.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.512 -0.742 . . . . 0.0 109.508 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.461 HD13 HG21 ' B' ' 17' ' ' VAL . 40.1 pt -137.66 157.97 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -0.967 . . . . 0.0 110.626 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' B' ' 14' ' ' THR . 66.3 m-85 -111.91 146.85 37.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.604 -0.685 . . . . 0.0 110.364 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.488 HG11 HD11 ' B' ' 30' ' ' ILE . 66.3 t -127.78 116.55 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 109.598 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.0 136.85 39.29 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.545 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.7 p -96.02 168.3 10.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.444 -0.785 . . . . 0.0 110.063 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt -61.8 -8.84 5.34 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.315 -0.866 . . . . 0.0 111.29 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 47.7 p -95.43 -19.74 19.64 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.079 -1.013 . . . . 0.0 110.597 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.31 6.23 22.24 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 10.5 tttp -84.66 129.7 34.8 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.093 -1.239 . . . . 0.0 109.968 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.6 m -113.21 128.73 56.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.084 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 38.4 mt -109.28 141.19 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.504 -0.748 . . . . 0.0 110.406 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.422 HG23 ' CE1' ' B' ' 4' ' ' PHE . 27.6 m -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.366 -0.834 . . . . 0.0 109.176 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.414 ' CD2' ' CE ' ' B' ' 33' ' ' LYS . 35.0 mt -123.42 154.35 39.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.987 . . . . 0.0 111.137 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -106.32 114.98 29.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.443 -0.786 . . . . 0.0 109.034 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.468 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.4 m -140.01 176.76 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 111.039 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.403 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.1 mp0 -113.19 166.87 10.22 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.88 -25.73 19.62 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 O-C-N 123.493 1.26 . . . . 0.0 110.192 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.82 -1.9 57.03 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.171 -0.956 . . . . 0.0 110.552 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -71.19 140.57 50.54 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.123 -0.986 . . . . 0.0 110.567 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.9 p -83.62 159.2 21.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 110.763 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.629 HG23 HD12 ' B' ' 43' ' ' LEU . 44.1 mm -59.71 -40.57 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.42 -0.8 . . . . 0.0 109.621 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -56.85 -34.58 67.95 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 109.579 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -70.59 -33.6 71.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.514 -0.741 . . . . 0.0 109.329 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 82.0 t -69.91 -40.22 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.415 -0.803 . . . . 0.0 109.186 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -62.86 -41.32 99.32 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.419 -0.801 . . . . 0.0 109.083 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.77 74.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.537 -0.727 . . . . 0.0 109.297 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.414 ' CE ' HG12 ' B' ' 17' ' ' VAL . 6.0 mttm -68.07 -40.5 82.71 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.535 -0.728 . . . . 0.0 109.555 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.75 HD13 HD12 ' B' ' 69' ' ' LEU . 36.8 mt -66.78 -37.34 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.312 -0.868 . . . . 0.0 109.115 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.55 -47.71 84.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.418 -0.801 . . . . 0.0 109.254 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.44 -31.67 67.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.508 -0.745 . . . . 0.0 110.613 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.414 ' CE ' ' CD2' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -83.42 -36.96 23.84 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.293 -0.879 . . . . 0.0 111.262 -179.312 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -108.11 -55.86 2.32 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.106 -0.996 . . . . 0.0 110.55 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 125.88 15.37 2.9 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.474 HG23 ' HD2' ' B' ' 37' ' ' PRO . 90.6 mt -91.25 142.95 27.63 Favored Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.154 -1.203 . . . . 0.0 109.749 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.495 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.6 Cg_endo -68.22 134.79 32.43 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.638 1.336 . . . . 0.0 110.622 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.91 -25.64 81.72 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 O-C-N 123.695 1.366 . . . . 0.0 111.012 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.68 -22.01 64.4 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 109.902 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.495 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.2 mp0 -101.01 -4.25 27.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.454 -0.779 . . . . 0.0 110.513 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -94.26 142.5 27.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.07 130.99 45.59 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.421 -0.799 . . . . 0.0 109.725 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.81 ' HB3' HD12 ' B' ' 50' ' ' LEU . 24.5 mt -104.64 118.72 37.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.244 -0.91 . . . . 0.0 110.448 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.779 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.32 135.37 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.405 -0.81 . . . . 0.0 109.723 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.613 ' HB2' HD23 ' B' ' 67' ' ' LEU . 78.9 t80 -140.72 150.49 43.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.453 -0.779 . . . . 0.0 110.053 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.01 0.4 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.482 -0.761 . . . . 0.0 111.253 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.409 ' CA ' HD22 ' A' ' 26' ' ' LEU . . . 78.77 1.97 84.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 136.65 49.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.084 -1.245 . . . . 0.0 110.178 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -78.41 135.17 37.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.831 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.81 HD12 ' HB3' ' B' ' 43' ' ' LEU . 49.1 mt -83.79 140.72 31.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.296 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.58 131.27 39.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.346 -0.846 . . . . 0.0 110.418 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.467 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 76.7 m-20 -48.3 -32.43 7.34 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.438 -0.789 . . . . 0.0 111.051 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.07 -2.69 90.6 Favored Glycine 0 N--CA 1.493 2.492 0 C-N-CA 120.132 -1.032 . . . . 0.0 110.599 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.446 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.8 mmt85 -99.47 153.34 19.1 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.272 . . . . 0.0 110.445 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 82.6 p -102.2 164.63 11.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.451 -0.781 . . . . 0.0 110.174 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.505 HD22 HG21 ' B' ' 61' ' ' ILE . 65.8 mt -53.49 -44.82 69.35 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.28 -0.887 . . . . 0.0 110.743 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 42.3 t -56.62 -35.55 68.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.371 -0.831 . . . . 0.0 111.02 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -59.71 -28.98 67.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.296 -0.878 . . . . 0.0 110.407 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.638 ' CD2' HD22 ' B' ' 50' ' ' LEU . 64.3 m-85 -100.94 24.57 9.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.332 -0.855 . . . . 0.0 110.228 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 50.64 30.76 5.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.489 -0.757 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.505 HG21 HD22 ' B' ' 56' ' ' LEU . 86.1 mt -81.4 114.37 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.409 -0.807 . . . . 0.0 109.926 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -105.77 171.13 7.5 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.372 -0.83 . . . . 0.0 110.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.443 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.1 OUTLIER -46.62 155.11 0.26 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.548 -0.72 . . . . 0.0 111.128 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 63.38 13.11 6.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.702 -0.624 . . . . 0.0 111.003 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.9 141.38 49.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 58.7 m -107.4 115.08 29.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.321 -0.862 . . . . 0.0 109.942 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.613 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.7 mt -102.44 161.13 13.95 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -0.856 . . . . 0.0 110.378 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -108.76 136.79 47.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.312 -0.868 . . . . 0.0 109.806 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.75 HD12 HD13 ' B' ' 30' ' ' ILE . 6.9 tt -107.31 135.96 47.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.176 -0.952 . . . . 0.0 110.466 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.68 ' N ' HD23 ' B' ' 69' ' ' LEU . 47.8 t -125.08 155.97 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.758 . . . . 0.0 110.048 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.06 106.5 18.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.325 -0.86 . . . . 0.0 110.353 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.452 ' NH2' ' CE1' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -85.72 86.11 7.38 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.358 -0.838 . . . . 0.0 110.14 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 58.46 164.81 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.409 -0.807 . . . . 0.0 110.354 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -170.05 145.78 2.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.351 -0.843 . . . . 0.0 110.237 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 123.37 -105.09 0.89 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 CA-C-O 118.017 -1.435 . . . . 0.0 109.517 179.958 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.223 0.535 . . . . 0.0 110.237 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.99 -169.27 2.76 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.34 -0.85 . . . . 0.0 110.245 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mp -112.0 24.48 12.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.444 -0.785 . . . . 0.0 109.654 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.08 66.58 2.51 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -147.83 60.47 1.13 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.304 -1.115 . . . . 0.0 110.226 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.11 166.65 39.62 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.11 -27.81 8.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.44 -1.035 . . . . 0.0 110.221 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.56 -25.96 67.64 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.863 . . . . 0.0 110.285 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.4 -29.13 67.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.268 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.905 ' CD2' HG21 ' A' ' 14' ' ' VAL . 0.1 OUTLIER -134.58 106.86 7.2 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.476 -0.765 . . . . 0.0 110.087 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.708 ' O ' HG22 ' A' ' 14' ' ' VAL . 1.5 tt0 -54.05 143.54 21.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.373 -0.83 . . . . 0.0 109.796 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.461 ' N ' ' CD1' ' A' ' 12' ' ' PHE . 10.5 m-30 -59.72 -14.81 15.89 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.275 -0.89 . . . . 0.0 110.74 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -90.73 -3.89 70.55 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.905 HG21 ' CD2' ' A' ' 10' ' ' PHE . 35.6 m -57.12 -26.45 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.048 -1.266 . . . . 0.0 110.398 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -160.21 153.67 18.8 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.342 -0.849 . . . . 0.0 110.173 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.57 -15.11 30.72 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.846 1.446 . . . . 0.0 110.733 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -9.74 58.66 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.294 -0.879 . . . . 0.0 110.588 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -24.41 55.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.12 -0.987 . . . . 0.0 110.292 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.59 120.3 0.59 Allowed Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.351 -0.843 . . . . 0.0 109.853 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.19 -15.34 35.46 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 123.948 1.499 . . . . 0.0 110.111 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.95 -31.87 59.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.43 -0.794 . . . . 0.0 109.37 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.45 -28.86 28.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.598 -0.689 . . . . 0.0 109.293 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.72 -37.98 67.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.547 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -81.55 -36.72 28.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.444 -0.785 . . . . 0.0 109.733 179.612 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.19 -32.43 72.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.324 -0.86 . . . . 0.0 109.945 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.5 tp -83.0 -21.86 33.8 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.275 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -32.49 29.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.263 -0.898 . . . . 0.0 109.159 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 24' ' ' LEU . 66.7 t -80.42 -27.84 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 O-C-N 121.63 -0.669 . . . . 0.0 109.601 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -77.12 -33.91 56.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.8 ttm -74.65 -35.09 62.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 110.028 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.48 -29.9 59.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 110.204 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -50.4 21.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.347 -0.845 . . . . 0.0 110.083 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -60.46 -28.35 68.26 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.389 -0.819 . . . . 0.0 110.196 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -46.83 52.77 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.465 -0.772 . . . . 0.0 110.073 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -62.34 -31.05 71.63 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -81.76 -52.95 6.62 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.35 -0.844 . . . . 0.0 110.115 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.674 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 10.1 mm-40 -60.04 -25.43 65.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.481 -0.762 . . . . 0.0 110.284 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -83.71 -57.26 3.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.494 -0.754 . . . . 0.0 109.577 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -52.54 -35.99 54.62 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.49 -0.756 . . . . 0.0 109.14 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -80.25 -34.28 37.26 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.79 -51.11 66.28 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.428 -0.795 . . . . 0.0 109.585 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -70.8 -30.11 66.47 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.617 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -53.57 -39.31 64.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.359 -0.838 . . . . 0.0 109.171 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.36 -25.27 36.47 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.663 -0.648 . . . . 0.0 109.293 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.35 65.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.488 -0.758 . . . . 0.0 109.81 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.61 -41.97 13.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.47 -0.769 . . . . 0.0 110.085 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -26.84 68.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.208 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.3 -33.5 15.3 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.339 -0.851 . . . . 0.0 110.205 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.24 66.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.407 -0.808 . . . . 0.0 110.18 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.73 -17.49 63.46 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.424 -0.797 . . . . 0.0 110.4 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -96.23 -37.43 10.54 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.31 -0.869 . . . . 0.0 110.292 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 -33.01 18.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.391 -0.818 . . . . 0.0 110.249 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.41 -56.74 4.96 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.631 HG23 ' O ' ' A' ' 54' ' ' ILE . 5.2 tp -125.8 97.02 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.419 -1.048 . . . . 0.0 110.292 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.26 -25.85 18.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.883 . . . . 0.0 110.266 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.2 p -59.91 105.41 0.38 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.345 -0.847 . . . . 0.0 110.198 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.9 m -158.82 -63.55 0.08 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.456 -0.777 . . . . 0.0 110.098 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -170.01 67.74 0.15 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 9.5 m -120.25 71.49 0.91 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -1.091 . . . . 0.0 110.254 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -81.46 76.23 8.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.346 -0.846 . . . . 0.0 110.141 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.59 -41.93 7.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 110.353 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.513 ' HB2' ' HB2' ' A' ' 65' ' ' ALA . 36.2 p -129.07 85.84 2.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.292 -0.88 . . . . 0.0 110.262 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -63.38 -32.04 73.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.399 -0.813 . . . . 0.0 110.268 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -74.96 -30.53 61.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.186 -0.947 . . . . 0.0 109.026 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.513 ' HB2' ' HB2' ' A' ' 62' ' ' SER . . . -60.27 -48.87 79.88 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.564 -0.855 . . . . 0.0 108.819 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.12 -29.89 68.92 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 tt -76.23 -35.33 59.06 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.497 0.665 . . . . 0.0 109.563 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 1.3 mttt -81.22 -58.0 3.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.427 -0.795 . . . . 0.0 110.289 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 mtt -51.0 -37.3 44.25 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.363 -0.836 . . . . 0.0 110.642 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.2 m -70.02 -44.47 69.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 110.261 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.5 tp -83.59 -11.67 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.208 -0.933 . . . . 0.0 110.437 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 3.4 m -77.33 -44.68 28.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.207 -0.933 . . . . 0.0 109.711 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.28 -24.29 37.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.523 -0.736 . . . . 0.0 110.019 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -84.75 -34.08 22.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -75.63 -40.7 55.87 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.305 -0.872 . . . . 0.0 110.205 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.17 102.38 0.1 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.325 -0.859 . . . . 0.0 110.2 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.95 -83.45 0.16 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -91.29 116.8 29.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.346 -1.091 . . . . 0.0 110.139 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -121.43 41.32 3.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.322 -0.861 . . . . 0.0 110.158 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.92 24.05 32.64 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -172.69 150.08 2.06 Favored Pre-proline 0 N--CA 1.488 1.44 0 O-C-N 121.302 -1.116 . . . . 0.0 108.973 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HG3' ' CE2' ' A' ' 95' ' ' TYR . 55.1 Cg_endo -76.29 38.77 0.62 Allowed 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.588 1.309 . . . . 0.0 110.874 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 50.42 82.69 0.05 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.145 -0.972 . . . . 0.0 110.592 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.46 HD23 ' HG2' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -90.5 -28.49 18.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.307 -0.871 . . . . 0.0 110.303 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.3 m -62.11 -16.58 53.48 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.369 -0.832 . . . . 0.0 110.566 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 77.7 p -106.16 -24.71 12.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.099 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.446 ' C ' HG23 ' A' ' 88' ' ' THR . 14.3 mtt -60.92 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 110.04 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.446 HG23 ' C ' ' A' ' 87' ' ' MET . 69.4 p -148.35 -170.66 3.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.373 -0.83 . . . . 0.0 110.166 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.599 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.15 -34.64 78.86 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.421 -0.799 . . . . 0.0 109.345 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.415 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.8 mt-10 -85.45 -40.19 16.68 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.6 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.411 ' HB2' ' OG1' ' A' ' 88' ' ' THR . 0.3 OUTLIER -65.11 -42.51 93.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 108.528 179.109 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.46 ' HG2' HD23 ' A' ' 84' ' ' LEU . 79.9 mt-30 -70.02 -34.01 72.73 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.599 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.68 -35.69 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.8 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.58 -45.52 75.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.585 -0.697 . . . . 0.0 109.551 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.44 ' CE2' ' HG3' ' A' ' 82' ' ' PRO . 9.1 t80 -67.08 -32.68 74.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.84 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.57 -34.64 35.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 110.064 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.565 ' O ' HD12 ' A' ' 101' ' ' LEU . 9.8 mmt -83.89 -26.28 29.53 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.907 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -76.95 -31.37 56.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.421 -0.799 . . . . 0.0 110.199 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.6 mmm -85.04 -27.78 26.13 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.391 -0.818 . . . . 0.0 110.209 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -41.06 52.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.276 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.565 HD12 ' O ' ' A' ' 97' ' ' MET . 8.7 mt -73.49 -29.2 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.216 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -68.91 -47.75 65.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.314 -0.866 . . . . 0.0 110.236 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.08 103.46 0.17 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -95.17 61.78 2.46 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.386 -1.067 . . . . 0.0 110.155 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 52.01 81.81 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.348 -0.845 . . . . 0.0 110.518 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -160.32 44.39 0.2 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.37 -0.832 . . . . 0.0 110.133 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -145.91 85.84 0.17 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -149.12 84.2 1.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.364 -1.08 . . . . 0.0 110.258 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -143.9 54.46 1.31 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.294 -0.879 . . . . 0.0 110.211 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.44 53.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.827 . . . . 0.0 110.211 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.1 m -109.02 160.13 16.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.384 -0.822 . . . . 0.0 110.234 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.167 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.266 0.555 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -97.79 146.46 25.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.498 -0.751 . . . . 0.0 109.93 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.568 HD13 HG21 ' B' ' 17' ' ' VAL . 20.8 pt -137.56 159.03 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.34 -0.85 . . . . 0.0 110.269 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -111.93 142.25 44.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.527 -0.733 . . . . 0.0 110.545 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -127.53 117.91 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.399 -0.813 . . . . 0.0 109.602 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.4 mttm -100.2 130.5 46.34 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.411 -0.806 . . . . 0.0 110.599 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.542 HG22 ' HB3' ' B' ' 69' ' ' LEU . 61.2 p -96.01 175.26 6.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.001 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.433 HD11 HG13 ' B' ' 70' ' ' VAL . 12.7 mt -61.72 -11.31 11.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.251 -0.906 . . . . 0.0 111.039 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 62.9 p -95.72 13.82 25.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.962 -1.086 . . . . 0.0 110.791 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.64 7.84 70.36 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 21.6 tttm -84.83 130.05 34.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.985 -1.303 . . . . 0.0 109.919 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 41.7 m -113.33 125.58 54.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.359 -0.838 . . . . 0.0 110.245 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.28 136.23 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.414 -0.804 . . . . 0.0 110.417 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.4 m -102.19 120.83 41.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.301 -0.875 . . . . 0.0 109.448 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.9 mt -123.64 168.84 12.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.129 -0.982 . . . . 0.0 110.919 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -106.27 113.71 27.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.472 -0.767 . . . . 0.0 109.492 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.568 HG21 HD13 ' B' ' 3' ' ' ILE . 32.3 m -140.68 167.22 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.279 -0.888 . . . . 0.0 110.958 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.55 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -112.69 167.24 9.49 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.535 -0.728 . . . . 0.0 109.06 178.736 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.94 -26.75 18.3 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.449 1.236 . . . . 0.0 110.39 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.5 -3.15 58.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.183 -0.948 . . . . 0.0 110.523 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.07 141.92 50.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.0 110.47 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.2 p -83.26 158.04 22.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.57 -0.706 . . . . 0.0 110.345 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.716 HG22 ' CE ' ' B' ' 27' ' ' LYS . 44.5 mm -59.71 -36.41 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.349 -0.844 . . . . 0.0 109.494 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.25 -35.38 75.37 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.23 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -70.57 -31.79 68.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.461 -0.775 . . . . 0.0 109.19 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -70.11 -41.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.493 -0.754 . . . . 0.0 109.089 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.716 ' CE ' HG22 ' B' ' 23' ' ' ILE . 38.1 mttt -62.93 -42.87 99.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.476 -0.765 . . . . 0.0 109.34 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.24 -33.84 74.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.518 -0.739 . . . . 0.0 109.426 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -68.3 -39.29 82.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.506 -0.746 . . . . 0.0 109.558 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.409 HD13 HD22 ' B' ' 69' ' ' LEU . 10.5 mt -67.12 -38.96 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 119.669 -0.812 . . . . 0.0 109.18 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.65 -50.66 72.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.416 -0.802 . . . . 0.0 109.588 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.11 -25.89 61.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.375 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -84.01 -41.94 16.73 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.169 -0.957 . . . . 0.0 110.722 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -107.99 -54.51 2.49 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.16 -0.962 . . . . 0.0 110.502 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.45 21.45 1.81 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.543 HG23 ' HD2' ' B' ' 37' ' ' PRO . 15.2 mt -91.45 145.2 30.89 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.131 -1.217 . . . . 0.0 109.797 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.543 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.8 Cg_endo -67.28 131.51 25.17 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.586 1.308 . . . . 0.0 110.4 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.73 -24.59 79.16 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.676 1.356 . . . . 0.0 110.741 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.74 -25.11 64.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 109.636 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -101.28 9.78 41.37 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.574 -0.703 . . . . 0.0 110.209 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLN . . . . . 0.412 ' HG2' HD11 ' B' ' 69' ' ' LEU . 0.5 OUTLIER -94.25 137.04 33.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.206 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH2' HD11 ' B' ' 44' ' ' ILE . 0.1 OUTLIER -130.04 123.48 30.6 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.351 -0.843 . . . . 0.0 110.1 179.857 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.79 ' C ' HD12 ' B' ' 44' ' ' ILE . 25.0 mt -104.52 115.26 30.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.383 -0.823 . . . . 0.0 110.236 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.79 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.12 137.01 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.515 -0.74 . . . . 0.0 109.727 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -140.65 145.65 36.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.43 -0.794 . . . . 0.0 109.82 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.41 29.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.504 -0.747 . . . . 0.0 111.062 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.3 6.43 87.8 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -111.09 131.6 54.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.051 -1.264 . . . . 0.0 110.238 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -78.59 131.68 36.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.257 -0.902 . . . . 0.0 109.615 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.641 HD22 ' CG ' ' B' ' 59' ' ' TYR . 26.1 mt -83.95 139.01 32.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.904 . . . . 0.0 110.351 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.71 132.43 38.08 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.319 -0.863 . . . . 0.0 110.775 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.468 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 7.8 m-20 -48.42 -28.38 3.22 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.519 -0.738 . . . . 0.0 111.104 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.95 -6.69 88.12 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.59 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -99.38 156.27 17.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.072 -1.252 . . . . 0.0 110.45 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.8 p -102.12 162.24 13.07 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.822 . . . . 0.0 110.249 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.634 ' HA ' HD12 ' B' ' 61' ' ' ILE . 86.8 mt -53.42 -44.72 69.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.315 -0.865 . . . . 0.0 110.667 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.9 t -56.65 -34.5 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.322 -0.861 . . . . 0.0 110.991 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -59.63 -28.06 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.228 -0.92 . . . . 0.0 110.403 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.641 ' CG ' HD22 ' B' ' 50' ' ' LEU . 73.9 m-85 -101.18 27.42 6.15 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.382 -0.824 . . . . 0.0 109.958 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 m120 50.94 31.85 6.72 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.46 -0.775 . . . . 0.0 110.757 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.634 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.6 mt -81.7 113.8 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.049 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -105.72 167.93 9.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.367 -0.833 . . . . 0.0 110.122 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 12.2 pttp -46.46 153.09 0.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.496 -0.752 . . . . 0.0 110.918 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.4 OUTLIER 62.48 16.8 8.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.595 -0.691 . . . . 0.0 110.511 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.51 146.18 48.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 110.302 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -107.67 109.17 20.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.391 -0.818 . . . . 0.0 109.957 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.507 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.56 162.78 12.65 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.293 -0.88 . . . . 0.0 110.075 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -108.75 131.2 55.17 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.215 -0.928 . . . . 0.0 109.906 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.542 ' HB3' HG22 ' B' ' 7' ' ' THR . 57.6 tp -107.17 128.09 54.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 0.0 110.385 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.433 HG13 HD11 ' B' ' 8' ' ' LEU . 47.2 t -124.93 156.39 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.428 -0.795 . . . . 0.0 110.007 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.0 110.62 22.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -92.7 95.97 9.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.847 . . . . 0.0 110.186 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -86.2 131.62 34.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.421 -0.8 . . . . 0.0 110.253 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -128.3 83.56 2.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.348 -0.845 . . . . 0.0 110.202 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -140.92 -104.71 0.56 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.347 0 CA-C-O 118.008 -1.44 . . . . 0.0 109.525 -179.984 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 121.199 0.523 . . . . 0.0 110.226 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.35 -167.15 1.6 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.421 -0.799 . . . . 0.0 110.167 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 tp -110.99 24.59 12.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.452 -0.78 . . . . 0.0 109.515 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.97 -60.26 1.2 Allowed Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.14 103.94 5.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.45 -1.029 . . . . 0.0 110.204 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -116.48 -144.41 7.99 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -126.16 39.78 3.87 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.362 -1.081 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.59 -28.2 8.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.282 -0.886 . . . . 0.0 110.229 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -27.77 67.92 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.393 -0.817 . . . . 0.0 110.249 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.418 ' CD2' ' O ' ' A' ' 10' ' ' PHE . 38.2 p90 -163.25 121.61 2.0 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.422 -0.799 . . . . 0.0 110.08 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -157.34 37.7 0.29 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.359 -0.838 . . . . 0.0 110.097 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -167.28 -44.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.824 . . . . 0.0 110.201 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.59 54.92 0.94 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -137.84 -63.72 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.362 -1.081 . . . . 0.0 110.057 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.38 161.7 28.58 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.16 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.03 -20.93 28.3 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.805 1.424 . . . . 0.0 110.618 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 m -62.69 -17.39 60.56 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.71 -25.81 65.11 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.263 -0.898 . . . . 0.0 110.336 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -168.1 116.49 0.63 Allowed Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.324 -0.86 . . . . 0.0 110.08 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -70.94 -14.2 32.19 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 123.977 1.514 . . . . 0.0 110.016 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.403 ' HB3' ' CG1' ' B' ' 70' ' ' VAL . 7.1 mt-10 -74.23 -30.81 62.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.473 -0.767 . . . . 0.0 109.359 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.09 -30.01 22.91 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.41 -36.33 73.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.551 -0.718 . . . . 0.0 109.352 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.541 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -78.12 -32.2 50.31 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.55 -0.719 . . . . 0.0 109.634 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.5 -32.16 70.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.4 -0.812 . . . . 0.0 109.925 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 62.6 tp -82.54 -21.45 35.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.4 -0.813 . . . . 0.0 110.309 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.51 -27.31 34.54 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.259 -0.9 . . . . 0.0 109.314 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 24' ' ' LEU . 66.6 t -85.36 -26.31 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.592 -0.693 . . . . 0.0 109.772 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.17 -45.47 26.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.455 -0.778 . . . . 0.0 110.097 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -35.17 71.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.411 -0.806 . . . . 0.0 110.026 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -70.31 -34.63 72.94 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.368 -0.833 . . . . 0.0 110.041 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.9 -45.45 50.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.374 -0.829 . . . . 0.0 110.118 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.96 -47.55 84.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.416 -0.802 . . . . 0.0 110.18 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -40.63 97.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.444 -0.785 . . . . 0.0 110.179 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -53.5 -41.02 65.86 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.397 -0.814 . . . . 0.0 110.203 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -82.51 -47.1 12.57 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.403 -0.811 . . . . 0.0 109.936 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.477 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 6.1 mm100 -63.64 -20.31 65.58 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.363 -0.835 . . . . 0.0 110.262 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -84.13 -65.87 0.96 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.264 -0.897 . . . . 0.0 109.553 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.46 -26.8 21.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.332 -0.855 . . . . 0.0 109.563 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.33 -30.53 23.63 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.535 -0.728 . . . . 0.0 109.875 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -84.05 -23.61 30.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.272 -0.892 . . . . 0.0 109.98 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.448 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 2.8 mpt_? -82.3 -39.16 23.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.483 -0.761 . . . . 0.0 109.988 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.14 -33.21 63.46 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.81 67.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.355 -0.841 . . . . 0.0 109.991 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.98 -30.58 39.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.424 -0.797 . . . . 0.0 110.083 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.52 -37.87 71.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.069 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.71 -33.98 58.17 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.394 -0.816 . . . . 0.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.9 m -69.45 -35.42 75.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.36 -0.837 . . . . 0.0 110.159 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.95 -26.58 48.9 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.38 20.31 17.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.285 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -143.06 -45.67 0.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 110.065 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.19 16.45 26.1 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.38 -0.825 . . . . 0.0 110.357 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.41 -74.15 0.1 Allowed Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.485 ' O ' HD12 ' A' ' 54' ' ' ILE . 1.1 pp -86.46 66.61 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.303 -1.116 . . . . 0.0 110.14 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.58 139.9 48.01 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.83 . . . . 0.0 110.236 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.8 p -141.63 93.97 2.63 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.423 -0.798 . . . . 0.0 110.233 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.6 t -74.23 -158.13 0.06 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.386 -0.821 . . . . 0.0 110.1 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -159.45 98.08 0.17 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.709 -1.357 . . . . 0.0 109.709 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.9 p -81.85 62.71 5.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -1.037 . . . . 0.0 110.061 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 62' ' ' SER . 5.4 pt-20 -142.74 45.68 1.59 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.389 -0.82 . . . . 0.0 110.533 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.631 ' O ' ' N ' ' A' ' 63' ' ' ASP . 3.4 t70 -55.92 97.04 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.498 ' HB2' ' HB2' ' A' ' 65' ' ' ALA . 79.3 p -51.11 78.3 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.666 0.746 . . . . 0.0 110.724 -177.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.2 t0 -61.51 -31.28 71.27 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.736 -0.602 . . . . 0.0 110.165 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -76.11 -29.77 58.0 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.296 -0.877 . . . . 0.0 109.131 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' ' HB2' ' A' ' 62' ' ' SER . . . -61.81 -44.47 96.8 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.796 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -29.2 70.26 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -40.21 55.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.466 -0.771 . . . . 0.0 109.87 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HA ' HG22 ' A' ' 71' ' ' ILE . 10.8 mmtp -81.79 -55.28 4.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.387 -0.821 . . . . 0.0 110.516 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 tpp -52.37 -42.42 63.95 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.152 -0.968 . . . . 0.0 110.604 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 84.7 m -68.02 -42.86 80.01 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.311 -0.868 . . . . 0.0 110.559 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.415 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.3 tp -82.5 -12.99 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.231 -0.918 . . . . 0.0 110.413 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.9 m -76.08 -39.43 55.37 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.338 -0.851 . . . . 0.0 109.749 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -84.35 -27.09 27.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.416 -0.802 . . . . 0.0 110.079 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.18 -44.54 14.92 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -69.52 -38.58 77.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 110.202 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -105.62 87.36 2.58 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.877 . . . . 0.0 110.186 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -153.42 -73.4 0.01 OUTLIER Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 -71.92 -32.5 67.41 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.367 -1.078 . . . . 0.0 110.067 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.678 HG22 ' O ' ' A' ' 79' ' ' THR . 92.6 m 51.4 27.17 3.53 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.314 -0.866 . . . . 0.0 109.953 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.442 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 87.77 -87.18 1.52 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 108.905 -1.678 . . . . 0.0 108.905 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.846 HD23 ' HD2' ' A' ' 82' ' ' PRO . 0.2 OUTLIER 176.99 153.69 0.41 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.73 -0.865 . . . . 0.0 108.971 179.652 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.846 ' HD2' HD23 ' A' ' 81' ' ' LEU . 47.7 Cg_endo -75.6 48.84 2.25 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 123.59 1.31 . . . . 0.0 110.596 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.59 110.67 21.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.128 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.2 mp -57.88 -26.67 62.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.845 . . . . 0.0 110.217 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -14.51 62.96 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.338 -0.851 . . . . 0.0 110.327 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 t -109.76 -4.31 16.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.283 -0.886 . . . . 0.0 110.412 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 11.3 mtt -96.39 -163.66 1.07 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.202 -0.936 . . . . 0.0 110.129 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.6 p -141.5 -167.81 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.406 -0.808 . . . . 0.0 110.185 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.575 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.3 pt-20 -71.52 -32.36 68.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.457 -0.777 . . . . 0.0 109.207 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 26.7 mt-10 -85.24 -38.18 19.21 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.272 179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -43.21 89.19 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -68.07 -35.23 77.86 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.575 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.81 -37.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.788 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.46 -33.35 74.66 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.496 -0.752 . . . . 0.0 109.823 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -75.78 -31.66 59.58 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.36 -32.44 29.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.457 -0.777 . . . . 0.0 110.167 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.54 -29.77 27.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.36 -0.837 . . . . 0.0 109.689 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -75.35 -31.08 60.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.373 -0.829 . . . . 0.0 109.915 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 2.2 tpt -78.51 -37.84 42.13 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.385 -0.822 . . . . 0.0 110.026 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 t -66.67 -28.32 68.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.819 . . . . 0.0 110.083 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.418 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.1 mm? -99.94 -31.53 11.43 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.467 -0.771 . . . . 0.0 110.143 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -123.16 59.93 1.07 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.378 -0.826 . . . . 0.0 110.17 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -102.24 -63.92 0.74 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.37 75.44 1.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.376 -1.073 . . . . 0.0 110.22 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.94 -63.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.36 -0.838 . . . . 0.0 110.202 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.31 -40.4 2.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.339 -0.85 . . . . 0.0 110.187 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.43 -35.15 1.57 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -92.33 84.3 5.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.342 -1.093 . . . . 0.0 110.197 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -159.25 -71.05 0.08 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.386 -0.821 . . . . 0.0 110.228 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -104.42 29.95 5.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.147 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.4 p -124.02 155.28 38.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.387 -0.821 . . . . 0.0 110.211 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 117.965 -1.016 . . . . 0.0 110.164 179.964 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.435 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.4 ttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.253 0.549 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 140.68 29.48 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.33 -0.856 . . . . 0.0 109.725 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.41 158.06 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.235 -0.915 . . . . 0.0 110.32 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.81 143.85 42.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.71 -0.619 . . . . 0.0 110.681 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 64.1 t -127.99 124.58 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 109.517 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 13.1 mttt -99.88 134.11 43.27 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.423 -0.798 . . . . 0.0 110.291 -179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 40.3 p -95.47 172.89 7.8 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.331 -0.856 . . . . 0.0 110.302 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.475 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.6 mm? -61.26 -13.54 19.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.486 -0.759 . . . . 0.0 111.034 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.5 p -95.72 -5.77 41.36 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.026 -1.046 . . . . 0.0 110.997 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.99 9.43 57.21 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.1 OUTLIER -84.62 136.53 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.259 . . . . 0.0 109.779 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 31.0 m -113.07 127.32 56.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.229 -0.919 . . . . 0.0 110.373 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.29 137.27 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 23.3 m -102.09 120.68 40.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.3 mt -123.48 158.59 30.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.095 -1.003 . . . . 0.0 110.918 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -106.29 113.8 27.54 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 109.385 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.62 HG12 ' HD3' ' B' ' 29' ' ' LYS . 34.0 m -140.29 177.4 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.266 -0.896 . . . . 0.0 110.938 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.52 ' O ' HD12 ' B' ' 56' ' ' LEU . 18.3 mt-10 -113.03 164.61 15.07 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.89 -27.27 17.87 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.523 1.275 . . . . 0.0 110.282 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.63 -1.34 55.9 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.885 . . . . 0.0 110.735 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.99 143.87 50.67 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.073 -1.017 . . . . 0.0 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 81.1 p -83.4 159.15 21.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.491 -0.756 . . . . 0.0 110.606 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 44.7 mm -59.62 -37.45 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.381 -0.824 . . . . 0.0 109.461 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -60.22 -34.67 73.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.422 -0.799 . . . . 0.0 109.358 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.47 -33.77 71.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.0 109.264 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.1 t -70.04 -40.06 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.454 -0.779 . . . . 0.0 109.26 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -62.9 -42.62 99.85 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.462 -0.774 . . . . 0.0 109.206 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.56 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.481 -0.762 . . . . 0.0 109.368 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.62 ' HD3' HG12 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -68.15 -39.8 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.567 -0.708 . . . . 0.0 109.535 179.408 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.553 HD13 HD22 ' B' ' 69' ' ' LEU . 17.8 mt -67.01 -37.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.96 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 50.0 tt0 -60.77 -50.57 72.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.377 -0.827 . . . . 0.0 109.374 178.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -58.07 -27.72 63.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 110.517 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -83.93 -39.04 20.29 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.307 -0.871 . . . . 0.0 110.778 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -108.07 -56.85 2.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 127.23 19.19 1.96 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.079 -1.209 . . . . 0.0 110.079 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.518 HG23 ' HD2' ' B' ' 37' ' ' PRO . 25.2 mt -91.43 144.03 29.06 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.092 -1.24 . . . . 0.0 109.93 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.518 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.6 Cg_endo -68.28 132.3 25.5 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.714 1.376 . . . . 0.0 110.459 179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.67 -25.12 80.28 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.736 1.387 . . . . 0.0 110.816 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -26.15 64.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.418 -0.801 . . . . 0.0 109.84 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.439 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.6 mm100 -101.24 2.5 39.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.446 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -94.21 139.65 30.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.09 129.05 43.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.38 -0.825 . . . . 0.0 110.15 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.907 ' HB3' HD12 ' B' ' 50' ' ' LEU . 17.4 mt -104.71 118.57 36.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.797 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.09 135.09 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.436 -0.79 . . . . 0.0 109.992 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -140.73 149.5 42.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.606 -0.684 . . . . 0.0 109.543 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 28.46 0.52 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.423 -0.798 . . . . 0.0 111.088 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.36 2.1 78.14 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -111.04 136.79 49.52 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.093 -1.239 . . . . 0.0 110.215 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -78.4 138.99 38.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.227 -0.921 . . . . 0.0 109.824 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.907 HD12 ' HB3' ' B' ' 43' ' ' LEU . 47.9 mt -83.68 140.8 31.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.374 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.56 128.15 39.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.409 -0.807 . . . . 0.0 110.429 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 75.4 m-20 -48.35 -29.88 4.39 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.472 -0.767 . . . . 0.0 111.127 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.92 -5.19 89.58 Favored Glycine 0 N--CA 1.493 2.498 0 C-N-CA 120.121 -1.038 . . . . 0.0 110.622 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt-85 -99.34 155.97 17.24 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.983 -1.304 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.7 p -102.46 165.4 11.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.393 -0.817 . . . . 0.0 110.232 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.52 HD12 ' O ' ' B' ' 18' ' ' GLU . 64.9 mt -53.78 -47.62 70.57 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 29.1 t -56.75 -35.95 69.22 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.333 -0.854 . . . . 0.0 111.18 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -59.47 -27.38 66.06 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.107 -0.995 . . . . 0.0 110.236 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.473 ' CD2' HD22 ' B' ' 50' ' ' LEU . 34.2 m-85 -101.37 27.96 5.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.394 -0.816 . . . . 0.0 109.919 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 50.72 26.51 2.56 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.513 -0.742 . . . . 0.0 110.829 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.52 HD13 HD21 ' B' ' 67' ' ' LEU . 96.4 mt -81.53 109.56 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.274 -0.891 . . . . 0.0 109.906 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -105.68 173.38 6.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.379 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.7 151.72 0.56 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 111.088 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 35.0 mt-10 63.0 16.33 9.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.768 -0.582 . . . . 0.0 110.616 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.4 144.61 49.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 12.6 m -107.4 108.46 19.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 109.821 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.52 HD21 HD13 ' B' ' 61' ' ' ILE . 1.9 mt -102.31 160.29 14.66 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.318 -0.864 . . . . 0.0 110.041 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -108.95 132.89 53.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.278 -0.889 . . . . 0.0 110.151 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.553 HD22 HD13 ' B' ' 30' ' ' ILE . 61.8 tp -107.21 130.94 54.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.861 . . . . 0.0 109.95 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.403 ' CG1' ' HB3' ' A' ' 21' ' ' GLU . 16.6 t -124.81 149.58 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.452 -0.78 . . . . 0.0 110.155 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.0 mt -94.46 136.66 34.51 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.471 -0.768 . . . . 0.0 110.155 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 103.45 10.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.154 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.57 111.93 24.81 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.271 -0.893 . . . . 0.0 110.248 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.52 93.77 3.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.343 -0.848 . . . . 0.0 110.184 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -148.16 -134.23 2.42 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 CA-C-O 118.05 -1.417 . . . . 0.0 109.56 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.5 m170 . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.22 0.534 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.2 mtp -68.54 -178.06 1.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.356 -0.84 . . . . 0.0 110.265 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -112.05 24.71 12.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.502 -0.748 . . . . 0.0 109.599 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.49 -129.35 2.53 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 5' ' ' LEU . 5.5 mp -116.12 65.35 0.7 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -1.054 . . . . 0.0 110.19 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -99.15 35.25 4.8 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.25 27.51 4.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.356 -1.085 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 t -129.72 24.25 5.39 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 110.337 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -79.69 -24.56 41.66 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.214 -0.929 . . . . 0.0 110.115 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -111.09 72.64 0.79 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.323 -0.861 . . . . 0.0 110.2 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.8 tp10 -106.69 82.09 1.67 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.343 -0.848 . . . . 0.0 110.313 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 51.95 26.93 3.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.396 -0.815 . . . . 0.0 110.605 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -134.74 32.02 2.66 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.487 HG13 ' N ' ' A' ' 15' ' ' ASP . 10.1 p -136.27 -39.31 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.305 -1.115 . . . . 0.0 110.353 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.487 ' N ' HG13 ' A' ' 14' ' ' VAL . 23.3 t0 -113.53 123.31 33.4 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.308 -0.87 . . . . 0.0 110.014 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.84 -24.03 25.21 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 O-C-N 123.537 1.283 . . . . 0.0 110.681 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.2 t -61.32 -19.15 61.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.265 -0.897 . . . . 0.0 110.269 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.68 -27.39 63.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 110.152 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -159.64 113.69 1.5 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 110.059 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -72.01 -10.27 25.84 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.994 1.523 . . . . 0.0 110.432 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HB3' HG13 ' B' ' 70' ' ' VAL . 34.3 mt-10 -79.64 -31.94 41.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.876 . . . . 0.0 109.125 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.514 HD23 ' C ' ' A' ' 22' ' ' LEU . 4.8 tt -84.57 -29.32 25.95 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.63 -35.11 74.95 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.686 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.0 OUTLIER -77.44 -29.87 53.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.554 -0.716 . . . . 0.0 109.304 179.218 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.81 -29.67 68.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.463 -0.773 . . . . 0.0 109.777 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.01 -24.73 32.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.404 -0.81 . . . . 0.0 110.14 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -85.0 -30.58 24.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 109.639 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 24' ' ' LEU . 75.5 t -79.39 -30.97 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.469 -0.769 . . . . 0.0 109.809 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 55.1 m -76.53 -48.66 18.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.988 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.04 -43.03 99.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.354 -0.841 . . . . 0.0 110.02 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.84 -32.55 74.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.44 -0.788 . . . . 0.0 109.875 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.52 -47.21 86.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.43 -0.794 . . . . 0.0 110.024 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.43 -37.55 83.92 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.23 -34.94 77.16 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.434 -0.791 . . . . 0.0 110.096 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.89 -39.05 90.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.406 -0.809 . . . . 0.0 109.902 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -77.44 -44.1 30.2 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.371 -0.83 . . . . 0.0 110.157 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.583 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -64.13 -27.78 69.32 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.493 -0.755 . . . . 0.0 110.229 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -83.69 -56.38 3.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.417 -0.802 . . . . 0.0 109.472 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -53.23 -30.93 40.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.81 . . . . 0.0 109.177 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -86.02 -36.79 19.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.773 -0.579 . . . . 0.0 109.457 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.583 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -66.67 -53.51 33.05 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.929 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 mtt85 -64.23 -33.85 76.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.468 -0.77 . . . . 0.0 110.087 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -37.46 73.87 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.052 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.18 -27.14 42.62 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.315 -0.865 . . . . 0.0 109.874 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.24 58.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.8 . . . . 0.0 110.122 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.04 -47.9 14.16 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.113 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.08 72.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.865 . . . . 0.0 110.173 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.8 m -83.48 -41.97 17.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.38 -0.825 . . . . 0.0 110.194 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.64 -29.47 65.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.146 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -27.26 68.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.384 -0.823 . . . . 0.0 110.207 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -79.82 89.21 5.23 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.341 -0.85 . . . . 0.0 110.157 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.81 30.1 8.55 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 110.411 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -110.12 -61.18 0.5 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.9 tt -110.97 -18.98 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.286 -1.126 . . . . 0.0 110.363 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.64 -177.62 5.47 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.5 t -114.17 153.71 29.1 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.5 p -118.52 77.69 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.308 -0.87 . . . . 0.0 110.263 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.56 56.78 0.2 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.1 m -95.22 71.33 3.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.352 -1.087 . . . . 0.0 110.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -74.1 79.22 1.74 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.8 -25.99 12.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.396 -0.815 . . . . 0.0 110.238 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.463 ' HB2' ' HB2' ' A' ' 65' ' ' ALA . 60.2 p -112.37 68.71 0.68 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.168 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.5 -33.19 74.39 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.416 -0.803 . . . . 0.0 110.192 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -76.23 -28.24 57.1 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.205 -0.934 . . . . 0.0 109.221 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.463 ' HB2' ' HB2' ' A' ' 62' ' ' SER . . . -62.37 -42.7 99.62 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.584 -0.846 . . . . 0.0 108.882 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.85 -29.66 69.63 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -76.58 -37.53 56.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.578 -0.701 . . . . 0.0 109.871 179.248 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.457 ' HA ' HG22 ' A' ' 71' ' ' ILE . 21.5 mmtm -83.87 -55.24 4.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 110.361 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.9 tpt -52.86 -42.75 65.52 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.7 m -69.96 -41.85 73.95 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.457 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.8 tp -83.77 -12.08 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 110.59 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 68' ' ' LYS . 83.5 p -78.78 -45.42 21.06 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.175 -0.953 . . . . 0.0 109.801 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -82.97 -18.78 38.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.499 -0.751 . . . . 0.0 110.267 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -92.76 -34.4 13.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.184 -0.947 . . . . 0.0 110.677 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.426 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.7 tt0 -80.6 -30.4 36.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.23 -0.919 . . . . 0.0 110.448 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.37 105.34 0.11 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.337 -0.852 . . . . 0.0 110.444 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.23 -48.24 0.2 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.77 32.53 4.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.463 -1.022 . . . . 0.0 110.129 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.573 HG23 ' O ' ' A' ' 79' ' ' THR . 10.7 t -79.87 59.75 3.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.398 -0.813 . . . . 0.0 110.086 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.522 ' C ' HD12 ' A' ' 81' ' ' LEU . . . -79.54 4.43 64.26 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 81' ' ' LEU . 4.6 mp -143.06 130.57 10.95 Favored Pre-proline 0 C--N 1.308 -1.234 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -71.74 42.1 0.48 Allowed 'Trans proline' 0 C--N 1.303 -1.86 0 O-C-N 123.355 1.187 . . . . 0.0 110.728 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.9 t70 49.1 91.6 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.798 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.0 -27.74 65.97 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -66.56 -21.93 66.15 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.284 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.5 t -85.24 -24.66 27.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 110.19 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 40.1 mtt -59.96 116.6 4.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.496 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.6 p -73.75 -160.74 0.09 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.496 -0.752 . . . . 0.0 110.433 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 pt-20 -70.78 -30.04 66.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.514 -0.741 . . . . 0.0 109.149 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.453 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 6.9 mt-10 -83.44 -38.37 21.97 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.496 ' HB2' ' N ' ' A' ' 88' ' ' THR . 69.5 mm-40 -65.37 -43.69 89.98 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -66.95 -35.27 79.6 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.99 -36.95 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.77 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.96 81.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.79 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.18 -54.52 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.072 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.3 -34.15 74.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.724 ' HG2' HD23 ' A' ' 101' ' ' LEU . 53.5 ttp -80.91 -25.28 37.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.799 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -41.29 97.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.427 -0.796 . . . . 0.0 109.997 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 41.5 mmm -82.17 -24.73 34.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.378 -0.826 . . . . 0.0 110.231 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -34.62 42.55 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.38 -0.825 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.724 HD23 ' HG2' ' A' ' 97' ' ' MET . 0.5 OUTLIER -59.5 -22.82 62.16 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.35 -0.844 . . . . 0.0 110.284 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.62 -27.7 25.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.293 -0.879 . . . . 0.0 110.194 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 72.27 99.78 0.07 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -160.21 102.13 1.41 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -1.097 . . . . 0.0 110.224 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -87.08 -37.1 17.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.377 -0.827 . . . . 0.0 110.274 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.04 -58.58 0.27 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.385 -0.822 . . . . 0.0 110.267 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.31 -112.6 2.52 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -164.55 113.33 1.12 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.407 -1.055 . . . . 0.0 110.354 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.0 88.82 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.33 -0.856 . . . . 0.0 110.587 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -127.94 42.1 3.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.436 -0.79 . . . . 0.0 110.111 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 28.7 t -169.3 -51.1 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.332 -0.855 . . . . 0.0 110.192 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.265 179.995 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.442 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.3 ttp . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.21 0.528 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.69 140.55 29.41 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.405 -0.81 . . . . 0.0 109.708 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.654 HD13 HG21 ' B' ' 17' ' ' VAL . 42.6 pt -137.33 158.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.19 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -111.67 145.88 38.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.557 -0.714 . . . . 0.0 110.427 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' B' ' 12' ' ' THR . 61.7 t -127.89 122.55 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.452 -0.78 . . . . 0.0 109.95 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.473 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.38 128.51 46.43 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.515 -0.741 . . . . 0.0 110.257 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.505 HG22 HD23 ' B' ' 69' ' ' LEU . 66.8 p -95.74 177.51 5.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.371 -0.83 . . . . 0.0 110.473 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.471 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.6 mm? -61.12 -16.98 50.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.44 -0.788 . . . . 0.0 110.841 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.6 p -96.04 21.71 8.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.065 -1.022 . . . . 0.0 110.661 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.6 15.96 58.13 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.9 ttpm? -84.73 131.58 34.55 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.128 -1.219 . . . . 0.0 109.821 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 22.5 m -112.84 125.21 54.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.402 HD13 HG21 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -109.65 141.52 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.399 -0.813 . . . . 0.0 110.258 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.613 ' C ' HD12 ' B' ' 15' ' ' LEU . 7.4 m -101.94 120.06 39.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.295 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.613 HD12 ' C ' ' B' ' 14' ' ' THR . 7.2 mp -123.24 159.64 28.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.211 -0.931 . . . . 0.0 110.978 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.62 114.96 29.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 109.317 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.654 HG21 HD13 ' B' ' 3' ' ' ILE . 32.7 m -140.15 172.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.241 -0.912 . . . . 0.0 110.883 -179.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.576 ' O ' HD12 ' B' ' 56' ' ' LEU . 3.4 mp0 -112.86 165.1 13.82 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.54 -28.29 17.79 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.587 1.309 . . . . 0.0 110.384 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -84.66 -2.14 57.09 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.199 -0.938 . . . . 0.0 110.649 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.14 141.67 50.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.22 -0.925 . . . . 0.0 110.538 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.0 p -83.36 159.77 21.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 110.378 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.4 mm -59.93 -35.46 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.377 -0.827 . . . . 0.0 109.773 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -60.83 -38.04 84.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.828 . . . . 0.0 109.587 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -69.95 -31.51 69.29 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 109.195 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 22' ' ' THR . 67.2 t -70.1 -39.8 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.0 109.086 179.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.05 -42.16 99.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.565 -0.709 . . . . 0.0 109.144 179.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.27 -34.74 75.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.5 -0.75 . . . . 0.0 109.243 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.523 ' HD3' HG12 ' B' ' 17' ' ' VAL . 17.6 mttp -68.13 -35.48 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.328 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.2 mt -67.71 -42.04 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.447 -0.783 . . . . 0.0 109.279 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 11.4 tt0 -60.11 -49.58 77.09 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.805 . . . . 0.0 109.445 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.35 -25.81 62.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.379 -0.826 . . . . 0.0 110.393 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -84.04 -43.97 14.59 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.262 -0.898 . . . . 0.0 110.873 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -107.99 -50.29 3.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.219 -0.926 . . . . 0.0 110.631 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.55 18.23 3.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 110.074 -1.211 . . . . 0.0 110.074 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.545 HG23 ' HD2' ' B' ' 37' ' ' PRO . 91.0 mt -91.28 145.32 31.26 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.133 -1.216 . . . . 0.0 109.735 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.545 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.2 Cg_endo -67.75 133.93 31.02 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.579 1.304 . . . . 0.0 110.505 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.71 -25.94 81.97 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.781 1.411 . . . . 0.0 110.746 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.7 -21.98 64.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.785 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.424 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.2 mt-30 -101.18 0.59 37.86 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.463 -0.773 . . . . 0.0 110.337 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -94.25 138.51 32.18 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.892 . . . . 0.0 110.472 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.501 ' C ' HD22 ' B' ' 43' ' ' LEU . 1.2 mtt85 -130.06 128.53 42.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.715 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.776 ' C ' HD12 ' B' ' 44' ' ' ILE . 4.5 mm? -104.44 114.94 29.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.367 -0.833 . . . . 0.0 110.37 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.776 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.23 134.07 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.561 -0.712 . . . . 0.0 109.811 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -140.92 148.6 40.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.421 -0.799 . . . . 0.0 109.95 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.49 28.57 0.51 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 111.134 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.58 2.16 84.38 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.03 130.99 55.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.117 -1.225 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -78.52 136.68 37.62 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.318 -0.864 . . . . 0.0 109.814 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.753 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.4 mt -83.99 141.09 31.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.302 -0.874 . . . . 0.0 110.303 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -93.79 133.12 37.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.357 -0.84 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.515 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 15.8 m-20 -48.17 -30.62 4.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.514 -0.741 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -5.51 89.21 Favored Glycine 0 N--CA 1.494 2.548 0 C-N-CA 120.159 -1.019 . . . . 0.0 110.732 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.446 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.1 mmt-85 -99.28 155.12 17.67 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.053 -1.263 . . . . 0.0 110.477 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.5 p -102.16 163.97 11.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.46 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.576 HD12 ' O ' ' B' ' 18' ' ' GLU . 83.5 mt -53.69 -45.44 70.37 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.352 -0.843 . . . . 0.0 110.877 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 18.2 t -56.58 -34.2 66.93 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.408 -0.807 . . . . 0.0 110.956 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -59.7 -27.79 66.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.753 ' CD2' HD22 ' B' ' 50' ' ' LEU . 76.7 m-85 -101.19 26.0 7.58 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -0.844 . . . . 0.0 110.166 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 50.68 30.4 4.9 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.436 -0.79 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.502 HD13 HD21 ' B' ' 67' ' ' LEU . 94.7 mt -81.41 113.64 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.215 -0.928 . . . . 0.0 109.84 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -105.68 170.44 7.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.366 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.1 pttt -46.71 152.46 0.48 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.5 -0.75 . . . . 0.0 111.11 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.4 mm-40 63.31 15.03 8.34 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.688 -0.632 . . . . 0.0 110.696 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.74 144.47 49.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.147 -0.97 . . . . 0.0 110.073 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -107.44 113.18 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.81 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.502 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.39 162.45 12.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.4 -0.813 . . . . 0.0 110.125 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -108.74 132.59 53.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 109.665 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.505 HD23 HG22 ' B' ' 7' ' ' THR . 42.7 tp -106.89 131.25 54.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 110.314 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.402 HG13 ' HB3' ' A' ' 21' ' ' GLU . 45.6 t -124.96 155.88 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.417 -0.802 . . . . 0.0 110.289 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt -94.14 136.32 34.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 110.132 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 32.7 ttt-85 -98.21 82.93 3.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.25 -0.907 . . . . 0.0 110.194 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.53 -170.44 1.86 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.393 -0.817 . . . . 0.0 110.125 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.08 41.76 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.419 -0.801 . . . . 0.0 110.144 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 161.52 121.54 0.58 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 CA-C-O 117.936 -1.48 . . . . 0.0 109.548 -179.997 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.2 p80 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.224 0.535 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mtp -143.49 178.8 7.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.242 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.6 25.0 12.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.436 -0.79 . . . . 0.0 109.527 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.24 51.01 3.38 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 mp -76.82 68.82 3.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.371 -1.076 . . . . 0.0 110.196 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -120.54 36.8 3.25 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -81.53 -31.54 32.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.4 -1.059 . . . . 0.0 110.059 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 p -77.75 -14.27 59.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.779 . . . . 0.0 110.449 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -56.81 -32.52 65.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.224 -0.922 . . . . 0.0 110.318 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -112.25 93.31 4.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.365 -0.835 . . . . 0.0 110.158 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -80.55 61.63 4.34 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.408 -0.808 . . . . 0.0 110.129 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -146.21 70.19 1.22 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.803 . . . . 0.0 110.22 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.615 ' H ' ' HB2' ' A' ' 18' ' ' ALA . . . 125.9 -63.1 0.59 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.422 HG13 ' N ' ' A' ' 15' ' ' ASP . 11.6 p -61.51 -34.92 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.476 -1.014 . . . . 0.0 110.256 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.422 ' N ' HG13 ' A' ' 14' ' ' VAL . 0.5 OUTLIER -78.99 163.25 61.21 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.367 -0.833 . . . . 0.0 110.316 -179.785 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.482 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 46.6 Cg_endo -71.47 -20.24 27.56 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.854 1.45 . . . . 0.0 110.751 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 t -67.32 -13.61 62.16 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.299 -0.876 . . . . 0.0 110.579 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.615 ' HB2' ' H ' ' A' ' 13' ' ' GLY . . . -86.87 -23.69 25.17 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.185 -0.947 . . . . 0.0 110.504 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -169.47 118.65 0.57 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.191 -0.943 . . . . 0.0 110.156 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.95 -14.61 35.71 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 O-C-N 123.785 1.413 . . . . 0.0 110.184 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -74.15 -31.13 62.59 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.795 . . . . 0.0 109.315 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mp -87.87 -31.15 19.65 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.482 ' HB2' ' CB ' ' A' ' 16' ' ' PRO . . . -71.74 -31.11 66.33 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.291 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.596 HD23 HD22 ' B' ' 8' ' ' LEU . 21.5 tp -80.77 -34.7 34.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.58 -0.7 . . . . 0.0 109.457 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.3 -33.3 75.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.429 -0.794 . . . . 0.0 109.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.09 -22.02 33.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.428 -0.795 . . . . 0.0 110.266 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -82.34 -32.05 29.55 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.254 -0.904 . . . . 0.0 109.12 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 24' ' ' LEU . 59.2 t -81.38 -28.33 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.641 -0.662 . . . . 0.0 109.662 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.2 -43.64 56.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.452 -0.78 . . . . 0.0 109.96 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.03 83.68 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.417 -0.802 . . . . 0.0 109.818 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -42.71 99.21 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.444 -0.785 . . . . 0.0 109.951 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -66.05 -44.59 84.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.356 -0.84 . . . . 0.0 109.987 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -66.13 -43.63 86.56 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.475 -0.765 . . . . 0.0 110.034 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.99 -43.68 91.76 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.0 110.12 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.33 -40.26 85.73 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.377 -0.827 . . . . 0.0 110.102 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -37.67 69.07 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.402 -0.811 . . . . 0.0 109.992 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.678 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.2 tp60 -75.16 -26.01 58.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.383 -0.823 . . . . 0.0 109.981 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -83.77 -57.5 3.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.421 -0.8 . . . . 0.0 109.677 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -52.37 -31.71 35.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.465 -0.772 . . . . 0.0 109.216 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.1 -34.21 22.25 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.678 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.72 -51.65 64.03 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.485 -0.759 . . . . 0.0 109.675 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.5 ptt180 -66.75 -30.99 71.35 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.354 -0.841 . . . . 0.0 109.754 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -54.27 -41.14 68.49 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.37 -0.831 . . . . 0.0 109.182 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.98 -26.05 56.39 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.98 -27.45 64.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.587 -0.696 . . . . 0.0 109.674 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.54 14.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.483 -0.76 . . . . 0.0 110.038 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.17 -30.48 70.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.413 -0.804 . . . . 0.0 110.144 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.03 -42.5 12.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.378 -0.826 . . . . 0.0 110.166 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.45 -32.89 74.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.39 -0.819 . . . . 0.0 110.14 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.88 -27.7 68.98 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.452 -0.78 . . . . 0.0 110.05 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 55' ' ' ALA . 8.4 mm-40 -111.41 27.02 10.07 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -0.847 . . . . 0.0 110.201 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -148.09 -52.62 0.19 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.309 -0.869 . . . . 0.0 110.084 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.66 -49.42 18.58 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.61 ' N ' HD12 ' A' ' 54' ' ' ILE . 5.4 mp -110.01 -24.55 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.488 -1.007 . . . . 0.0 110.137 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 54' ' ' ILE . . . 58.76 167.05 0.05 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.34 -0.85 . . . . 0.0 110.26 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 10.0 p -105.35 177.04 4.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 110.253 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.3 p -98.13 -176.64 3.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.369 -0.832 . . . . 0.0 110.262 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -121.75 50.62 0.83 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.15 63.57 8.18 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.402 -1.058 . . . . 0.0 110.049 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.06 83.49 7.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.368 -0.833 . . . . 0.0 110.267 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.54 -34.23 76.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.316 -0.865 . . . . 0.0 110.061 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.489 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 1.8 m -111.39 73.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.339 -0.851 . . . . 0.0 110.131 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -73.05 -37.59 66.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.375 -0.828 . . . . 0.0 110.401 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -78.14 -32.9 50.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.169 -0.957 . . . . 0.0 109.471 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.489 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -61.49 -37.06 82.28 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.402 -0.919 . . . . 0.0 108.736 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.456 ' O ' HG23 ' A' ' 70' ' ' THR . 5.9 mt -69.55 -31.44 69.63 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.14 -43.89 55.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.583 -0.698 . . . . 0.0 109.576 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -75.9 -53.42 8.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.497 -0.752 . . . . 0.0 110.094 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.0 ttt -49.36 -37.34 24.47 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.256 -0.903 . . . . 0.0 110.743 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.456 HG23 ' O ' ' A' ' 66' ' ' LEU . 15.5 p -71.09 -39.59 72.05 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.334 -0.854 . . . . 0.0 110.526 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.411 HG22 ' O ' ' A' ' 68' ' ' LYS . 5.1 tp -83.93 -16.82 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.256 -0.903 . . . . 0.0 110.289 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.87 -41.19 60.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.946 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -86.63 -19.24 29.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.46 -0.775 . . . . 0.0 110.28 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -92.02 -42.91 9.72 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.28 -0.887 . . . . 0.0 110.338 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.43 -33.3 60.9 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.341 -0.849 . . . . 0.0 110.061 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.401 ' CD2' ' O ' ' A' ' 76' ' ' PHE . 21.6 t80 -96.25 21.35 9.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.45 -0.781 . . . . 0.0 110.327 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.87 -37.04 57.2 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.306 -1.517 . . . . 0.0 109.306 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.38 114.06 28.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.428 -1.042 . . . . 0.0 110.141 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -124.32 41.1 3.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.404 -0.81 . . . . 0.0 110.258 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.64 48.25 1.37 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -172.45 147.7 1.77 Allowed Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.332 -1.099 . . . . 0.0 108.881 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.56 63.78 2.96 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 123.593 1.312 . . . . 0.0 110.46 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 83' ' ' ASP . 36.1 p-10 -54.36 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.342 -0.849 . . . . 0.0 110.465 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.645 HD23 ' HG2' ' A' ' 92' ' ' GLN . 1.9 mt -94.73 -29.35 14.83 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.285 -0.885 . . . . 0.0 110.181 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.66 -22.08 43.82 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.344 -0.847 . . . . 0.0 110.411 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.4 t -103.49 -19.24 14.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.31 -0.869 . . . . 0.0 110.472 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 26.4 mtp -90.97 129.07 37.02 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.287 -0.883 . . . . 0.0 110.357 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.481 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 81.4 p -72.44 -157.21 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.423 -0.798 . . . . 0.0 110.254 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.556 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.4 mt-10 -75.82 -29.26 58.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.447 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 2.6 mp0 -85.48 -36.53 20.5 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.481 ' HB2' ' N ' ' A' ' 88' ' ' THR . 63.1 mm-40 -66.26 -44.35 83.87 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.645 ' HG2' HD23 ' A' ' 84' ' ' LEU . 72.5 mt-30 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.556 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -70.64 -33.69 54.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.737 -0.602 . . . . 0.0 109.401 178.92 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.19 91.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.432 -0.793 . . . . 0.0 110.051 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -37.22 21.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 109.967 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.17 -37.88 81.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.271 -0.893 . . . . 0.0 110.185 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.2 ttt -81.51 -22.56 37.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.948 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.82 -44.29 73.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 110.094 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.14 -24.73 43.12 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.379 -0.825 . . . . 0.0 110.316 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.122 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 mt -97.23 14.67 25.17 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.342 -0.849 . . . . 0.0 110.442 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -139.77 41.73 1.99 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.221 -0.924 . . . . 0.0 110.268 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.71 40.08 0.03 OUTLIER Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -170.01 100.11 0.29 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.405 -1.056 . . . . 0.0 110.123 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -46.01 91.27 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.408 -0.807 . . . . 0.0 110.177 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -157.78 -54.99 0.07 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.219 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 131.68 -103.76 0.55 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -79.38 68.09 5.3 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.395 -1.061 . . . . 0.0 110.21 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.69 -38.1 67.65 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.35 -0.844 . . . . 0.0 110.123 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -166.19 70.48 0.13 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.355 -0.841 . . . . 0.0 110.163 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -167.13 115.27 0.81 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.427 -0.796 . . . . 0.0 110.178 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.272 179.944 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 44.6 ttp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -92.65 139.42 30.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.359 -0.838 . . . . 0.0 109.79 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.6 158.18 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 110.348 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -112.0 144.36 41.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.567 -0.708 . . . . 0.0 110.779 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.79 118.23 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.488 -0.757 . . . . 0.0 109.588 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 34.2 mttt -100.25 129.9 46.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.422 -0.798 . . . . 0.0 110.578 -179.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.54 HG22 ' HB3' ' B' ' 69' ' ' LEU . 40.0 p -96.13 174.98 6.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.377 -0.827 . . . . 0.0 110.136 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.596 HD22 HD23 ' A' ' 24' ' ' LEU . 37.0 mt -61.47 -13.6 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.335 -0.853 . . . . 0.0 111.056 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.2 p -95.72 18.13 13.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.099 -1.0 . . . . 0.0 110.698 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.28 11.62 61.94 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.0 tttp -84.96 127.76 34.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.055 -1.262 . . . . 0.0 109.895 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.9 m -112.94 125.15 54.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.264 -0.898 . . . . 0.0 110.272 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 31.6 mt -109.51 138.65 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.464 -0.773 . . . . 0.0 110.492 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.4 m -102.59 121.21 41.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.774 . . . . 0.0 109.452 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.53 HD23 ' HE3' ' B' ' 33' ' ' LYS . 49.1 mt -123.75 161.41 25.23 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.127 -0.983 . . . . 0.0 111.163 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -106.31 114.59 28.8 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.536 -0.727 . . . . 0.0 109.27 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.532 HG12 ' CE ' ' B' ' 29' ' ' LYS . 33.9 m -140.2 175.52 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.282 -0.886 . . . . 0.0 110.85 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.63 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.5 mp0 -113.36 165.88 12.38 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.91 -27.37 17.7 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 O-C-N 123.453 1.238 . . . . 0.0 110.234 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.68 -1.57 56.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.144 -0.972 . . . . 0.0 110.518 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -71.26 143.22 50.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.213 -0.929 . . . . 0.0 110.477 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 75.9 p -83.24 158.24 22.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.597 -0.689 . . . . 0.0 110.396 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.572 HG23 HD12 ' B' ' 43' ' ' LEU . 42.8 mm -59.71 -37.58 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 109.413 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -60.0 -34.59 73.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.427 -0.796 . . . . 0.0 109.148 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -70.33 -31.86 69.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.546 -0.721 . . . . 0.0 109.198 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.93 -39.77 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -62.85 -41.73 99.47 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.43 -33.2 73.31 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.551 -0.718 . . . . 0.0 109.229 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.532 ' CE ' HG12 ' B' ' 17' ' ' VAL . 7.2 mttp -68.43 -38.56 81.32 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.991 -0.684 . . . . 0.0 109.504 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.459 HD13 HD22 ' B' ' 69' ' ' LEU . 12.5 mt -67.41 -40.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.313 -0.867 . . . . 0.0 109.33 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -60.44 -49.36 77.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.299 -0.876 . . . . 0.0 109.574 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -58.05 -28.2 64.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.504 -0.747 . . . . 0.0 110.46 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.53 ' HE3' HD23 ' B' ' 15' ' ' LEU . 12.8 mmtt -83.61 -43.11 15.99 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.387 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -108.13 -116.98 0.27 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.36 -0.838 . . . . 0.0 109.842 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.67 22.1 0.21 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 83.0 mt -91.94 141.44 25.39 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.149 -1.206 . . . . 0.0 109.982 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.571 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.5 Cg_endo -71.71 139.16 33.27 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.637 1.336 . . . . 0.0 110.217 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.62 -27.16 84.34 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 O-C-N 123.675 1.355 . . . . 0.0 111.075 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -68.77 -23.6 64.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.287 -0.883 . . . . 0.0 109.904 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.571 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 5.8 mp0 -100.98 2.79 40.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.418 -0.801 . . . . 0.0 110.661 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -94.17 136.51 34.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.178 -0.951 . . . . 0.0 110.5 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -130.21 128.42 41.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.476 -0.765 . . . . 0.0 109.789 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.909 ' HB3' HD12 ' B' ' 50' ' ' LEU . 19.2 mt -104.54 118.51 36.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.303 -0.873 . . . . 0.0 110.336 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.23 133.67 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.533 -0.729 . . . . 0.0 109.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.5 ' HB2' HD23 ' B' ' 67' ' ' LEU . 31.0 t80 -140.77 152.44 45.23 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.367 -0.833 . . . . 0.0 109.995 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.417 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.14 27.43 0.31 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.459 -0.776 . . . . 0.0 111.118 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.73 1.16 83.07 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -110.95 138.05 47.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -1.21 . . . . 0.0 110.226 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -78.7 136.01 37.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.333 -0.854 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.909 HD12 ' HB3' ' B' ' 43' ' ' LEU . 57.5 mt -83.63 139.55 32.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.188 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 129.06 40.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.396 -0.815 . . . . 0.0 110.404 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.478 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 11.8 m-20 -48.4 -27.3 2.53 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.418 -0.801 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.61 86.97 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.118 -1.039 . . . . 0.0 110.564 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.438 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 21.0 mmt180 -99.23 155.8 17.3 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.988 -1.301 . . . . 0.0 110.428 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.3 p -102.2 165.22 11.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.385 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.63 HD12 ' O ' ' B' ' 18' ' ' GLU . 87.9 mt -53.59 -44.6 69.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.358 -0.839 . . . . 0.0 110.673 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.2 t -56.61 -36.49 69.48 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.451 -0.781 . . . . 0.0 110.865 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.89 -27.71 66.94 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.236 -0.915 . . . . 0.0 110.418 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.606 ' CG ' HD22 ' B' ' 50' ' ' LEU . 71.2 m-85 -101.12 25.28 8.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.352 -0.842 . . . . 0.0 110.209 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 30.1 m120 50.66 30.94 5.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.378 -0.826 . . . . 0.0 110.554 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.621 HD12 ' HA ' ' B' ' 56' ' ' LEU . 89.1 mt -81.38 112.54 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.856 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -105.65 169.35 8.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.366 -0.834 . . . . 0.0 110.191 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 7.5 pttm -46.51 152.7 0.43 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.582 -0.699 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 61.1 mm-40 63.08 15.42 8.47 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.768 -0.583 . . . . 0.0 110.719 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.92 49.84 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.191 -0.943 . . . . 0.0 110.078 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 17.7 m -107.62 110.74 22.69 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.989 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.5 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.2 mt -102.46 164.29 11.75 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.355 -0.84 . . . . 0.0 110.169 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 67.1 m80 -108.93 132.76 53.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' B' ' 7' ' ' THR . 57.0 tp -107.3 130.34 54.78 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.23 -0.919 . . . . 0.0 110.478 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 46.7 t -124.96 161.07 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.403 -0.811 . . . . 0.0 110.01 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.92 124.72 38.11 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.315 -0.866 . . . . 0.0 110.208 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -87.47 120.05 28.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.851 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' B' ' 73' ' ' LEU . 31.1 mt -130.6 130.08 43.55 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.335 -0.853 . . . . 0.0 110.244 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 25.9 ttt-85 -110.11 143.01 40.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.279 -0.888 . . . . 0.0 110.212 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -135.41 -98.25 0.56 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.557 -179.974 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.7 m80 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.247 0.546 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.529 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 57.3 mtp -146.68 -54.79 0.25 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.3 -0.875 . . . . 0.0 110.162 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 2' ' ' MET . 48.4 mt 72.99 41.45 0.5 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.75 -32.07 70.47 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.8 mp -74.76 78.53 2.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -1.041 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.38 -145.95 12.49 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.7 81.08 2.43 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.386 -1.067 . . . . 0.0 110.328 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.67 25.2 3.58 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.279 -0.888 . . . . 0.0 110.575 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 52.22 27.24 4.51 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.287 -0.883 . . . . 0.0 110.493 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.2 t80 57.47 105.17 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.342 -0.849 . . . . 0.0 110.346 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 44.35 1.2 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.324 -0.86 . . . . 0.0 110.306 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -158.23 24.84 0.25 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.306 -0.871 . . . . 0.0 110.238 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -128.51 2.69 6.58 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.965 -1.254 . . . . 0.0 109.965 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.6 m -65.05 -22.94 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.135 -1.215 . . . . 0.0 110.244 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.535 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -159.22 -179.96 1.22 Allowed Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.245 -0.909 . . . . 0.0 110.008 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.724 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 37.3 Cg_endo -61.64 78.87 0.09 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 O-C-N 123.573 1.301 . . . . 0.0 110.662 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 70.21 46.55 0.6 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.99 26.52 0.15 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.142 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.404 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 0.6 OUTLIER -169.39 108.54 0.48 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.118 -0.989 . . . . 0.0 110.532 179.832 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 19' ' ' ASP . 54.9 Cg_endo -73.63 -14.09 24.68 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 124.107 1.583 . . . . 0.0 109.668 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -74.2 -33.32 63.38 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.501 -0.75 . . . . 0.0 109.36 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.15 -28.86 34.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.55 -0.719 . . . . 0.0 109.23 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.724 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -73.61 -39.24 64.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 109.661 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.692 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -80.72 -30.3 36.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.433 -0.792 . . . . 0.0 109.863 179.753 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.07 -33.35 71.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.435 HD21 ' HA3' ' B' ' 47' ' ' GLY . 0.6 OUTLIER -82.9 -24.09 33.29 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.399 -0.813 . . . . 0.0 110.285 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -79.81 -31.22 40.68 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.238 -0.914 . . . . 0.0 109.121 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 24' ' ' LEU . 66.2 t -78.75 -27.86 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.682 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.6 p -73.15 -45.76 54.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.423 -0.798 . . . . 0.0 109.988 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -32.98 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.352 -0.843 . . . . 0.0 110.009 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.79 -28.2 61.53 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.367 -0.833 . . . . 0.0 110.153 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.564 ' OE2' HG21 ' B' ' 66' ' ' THR . 0.0 OUTLIER -71.31 -41.94 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.317 -0.864 . . . . 0.0 110.007 179.887 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.4 -29.18 67.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.347 -0.846 . . . . 0.0 110.024 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -39.47 65.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.875 . . . . 0.0 110.199 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.25 -36.92 85.61 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.387 -0.82 . . . . 0.0 110.184 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -74.78 -47.17 32.36 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.391 -0.818 . . . . 0.0 110.154 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.536 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.0 OUTLIER -68.63 -26.89 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.436 -0.79 . . . . 0.0 110.036 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -78.95 -53.28 7.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.483 -0.761 . . . . 0.0 109.659 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -54.06 -28.13 36.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.121 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -92.72 -33.79 14.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.646 -0.659 . . . . 0.0 109.546 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.536 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.35 -38.56 81.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.235 -0.916 . . . . 0.0 109.858 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -80.78 -35.06 33.65 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.462 -0.774 . . . . 0.0 110.007 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mmm180 -56.61 -41.32 76.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.299 -0.876 . . . . 0.0 109.97 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.13 -28.35 35.14 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.352 -0.842 . . . . 0.0 109.996 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.77 -30.01 59.0 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.497 -0.752 . . . . 0.0 110.106 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.03 -38.44 27.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.86 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.16 -33.74 76.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.49 -0.756 . . . . 0.0 110.241 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.77 -30.61 26.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.384 -0.823 . . . . 0.0 110.23 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.68 65.24 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.357 -0.84 . . . . 0.0 110.243 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.6 56.48 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.34 -0.85 . . . . 0.0 110.537 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -88.93 -67.26 0.85 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.144 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.83 -22.52 18.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.427 -0.795 . . . . 0.0 110.278 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.76 -102.08 0.04 OUTLIER Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.613 HG23 ' O ' ' A' ' 54' ' ' ILE . 6.1 tp -115.05 80.8 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.402 -1.058 . . . . 0.0 110.282 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.6 176.85 1.76 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.214 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 m -62.44 142.66 57.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.454 -0.779 . . . . 0.0 110.137 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -21.32 16.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.43 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -136.97 94.19 0.22 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.2 p -91.62 47.42 1.36 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.33 -1.1 . . . . 0.0 110.233 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -140.43 76.95 1.58 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.339 -0.85 . . . . 0.0 110.106 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.02 -28.93 69.83 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.384 -0.823 . . . . 0.0 110.272 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 2.8 m -123.92 80.83 1.85 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.339 -0.851 . . . . 0.0 110.282 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.13 -36.44 79.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.393 -0.817 . . . . 0.0 110.242 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.0 -29.04 60.76 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.193 -0.942 . . . . 0.0 109.145 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.451 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -62.06 -44.55 96.43 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.597 -0.841 . . . . 0.0 108.855 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tp -64.78 -28.52 69.63 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 tt -74.69 -47.71 30.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.52 -0.737 . . . . 0.0 109.875 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.01 -52.61 8.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.484 -0.76 . . . . 0.0 110.617 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.4 ttp -51.89 -38.86 57.76 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.226 -0.921 . . . . 0.0 110.65 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.5 m -70.31 -42.28 72.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.325 -0.86 . . . . 0.0 110.357 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.4 HD12 ' HA ' ' A' ' 71' ' ' ILE . 4.7 tp -81.53 -15.62 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.191 -0.943 . . . . 0.0 110.081 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -74.16 -39.89 62.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.394 -0.816 . . . . 0.0 109.672 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -80.88 -29.3 35.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.476 -0.765 . . . . 0.0 109.862 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -81.64 -49.46 10.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.41 -0.806 . . . . 0.0 110.105 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.16 -40.5 96.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.301 -0.874 . . . . 0.0 110.012 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -78.57 -23.83 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.44 86.93 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -79.27 102.26 8.49 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.451 -1.029 . . . . 0.0 110.109 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.02 81.02 1.39 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.292 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -129.03 38.55 2.0 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -170.86 146.17 2.13 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.35 -1.088 . . . . 0.0 108.928 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.44 62.87 2.83 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.506 1.266 . . . . 0.0 110.303 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -57.42 96.06 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.421 -0.799 . . . . 0.0 110.453 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 tp -85.09 -30.13 24.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.392 -0.817 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 61.5 m -71.72 -9.58 58.5 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.426 -0.796 . . . . 0.0 110.538 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.9 t -119.99 23.9 10.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.215 -0.928 . . . . 0.0 110.053 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.9 mtt -116.84 -162.37 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.425 -0.797 . . . . 0.0 109.898 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.1 p -141.51 -174.33 4.01 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.33 -0.856 . . . . 0.0 110.283 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.6 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.9 pt-20 -65.06 -32.77 74.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.548 -0.72 . . . . 0.0 109.356 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.43 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.5 mt-10 -85.32 -41.2 15.72 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 120.074 -0.65 . . . . 0.0 109.362 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -63.95 -39.89 95.18 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -71.8 -35.13 69.89 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.6 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -63.19 -41.1 91.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.846 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.411 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -62.26 -31.11 71.64 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -82.97 -36.06 25.42 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.737 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.98 -35.55 66.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.445 -0.784 . . . . 0.0 110.037 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.1 ppp? -79.22 -25.65 42.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.457 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -70.56 -33.78 71.5 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.451 -0.781 . . . . 0.0 109.849 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.19 -30.99 38.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.478 -0.764 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.9 -28.54 60.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.36 -0.837 . . . . 0.0 110.224 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.43 -28.61 31.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.293 -0.88 . . . . 0.0 110.231 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.37 -49.69 7.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.305 -0.872 . . . . 0.0 110.151 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 81.07 100.74 0.34 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -152.56 71.57 0.94 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.353 -1.086 . . . . 0.0 110.202 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -116.38 -49.27 2.67 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 110.222 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.66 -49.95 19.47 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.395 -0.816 . . . . 0.0 110.138 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.0 70.41 1.17 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -117.44 96.92 5.62 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.345 -1.091 . . . . 0.0 110.189 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -143.03 -66.49 0.38 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.448 -0.782 . . . . 0.0 110.18 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -69.68 -53.24 19.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.45 -0.781 . . . . 0.0 110.16 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.2 t -75.37 144.64 42.19 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.262 -0.899 . . . . 0.0 110.136 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.191 179.975 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.334 0.588 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -97.47 146.38 25.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -0.783 . . . . 0.0 110.035 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.572 HD13 HG21 ' B' ' 17' ' ' VAL . 24.1 pt -137.53 157.4 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 110.025 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -111.68 143.59 42.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.686 -0.634 . . . . 0.0 110.638 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 12' ' ' THR . 59.0 t -127.78 118.56 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.42 -0.8 . . . . 0.0 109.405 179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.3 mtpt -100.1 138.05 37.71 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.365 -0.835 . . . . 0.0 110.574 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 42.5 p -96.14 170.13 9.48 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.455 -0.778 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.62 HD11 HG13 ' B' ' 70' ' ' VAL . 17.5 mt -61.7 -10.58 8.96 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.407 -0.808 . . . . 0.0 111.181 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.3 p -95.29 -24.38 16.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.961 -1.087 . . . . 0.0 110.507 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.6 7.31 10.9 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.4 tttp -84.64 128.56 34.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.057 -1.26 . . . . 0.0 109.943 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 27.4 m -113.16 125.29 54.18 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 110.198 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.19 135.67 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.41 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 7.1 m -102.43 119.26 38.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 109.532 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.3 mt -123.58 166.97 14.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.107 -0.996 . . . . 0.0 110.859 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -106.5 114.63 28.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 109.382 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.572 HG21 HD13 ' B' ' 3' ' ' ILE . 33.0 m -140.39 169.53 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.991 -179.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.537 ' O ' HD12 ' B' ' 56' ' ' LEU . 27.4 mt-10 -112.46 166.18 11.52 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.512 -0.742 . . . . 0.0 109.101 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.48 -26.44 20.16 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.499 1.263 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.63 -2.4 57.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.133 -0.979 . . . . 0.0 110.474 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -71.28 141.35 50.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.157 -0.964 . . . . 0.0 110.396 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 44.0 p -83.43 157.51 22.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.542 -0.724 . . . . 0.0 110.385 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.574 HG23 HD12 ' B' ' 43' ' ' LEU . 39.9 mm -59.55 -31.18 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.259 -0.901 . . . . 0.0 109.529 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.93 -36.91 85.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.486 -0.759 . . . . 0.0 109.377 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -32.89 70.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.486 -0.759 . . . . 0.0 109.206 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.02 -39.86 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.434 -0.791 . . . . 0.0 109.126 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.456 ' HE2' HG22 ' B' ' 23' ' ' ILE . 6.4 mttm -63.02 -42.39 99.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.49 -0.756 . . . . 0.0 109.147 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.01 74.72 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.538 -0.726 . . . . 0.0 109.392 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -68.31 -39.74 81.93 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.459 -0.776 . . . . 0.0 109.616 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.473 HD13 HD22 ' B' ' 69' ' ' LEU . 13.3 mt -67.2 -38.8 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.373 -0.829 . . . . 0.0 109.248 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -52.41 65.24 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.473 -0.767 . . . . 0.0 109.768 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -58.09 -26.69 62.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.412 -0.805 . . . . 0.0 110.575 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.1 mmtm -83.97 -39.01 20.25 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.25 -0.906 . . . . 0.0 110.986 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -107.97 -54.89 2.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.208 -0.933 . . . . 0.0 110.501 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.75 14.28 2.34 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.492 HG23 ' HD2' ' B' ' 37' ' ' PRO . 23.0 mt -91.28 143.35 28.17 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.007 -1.29 . . . . 0.0 109.756 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.3 Cg_endo -69.88 137.06 34.23 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 123.665 1.35 . . . . 0.0 110.501 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.77 -27.04 84.16 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 O-C-N 123.728 1.383 . . . . 0.0 111.197 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.65 -22.62 64.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.262 -0.899 . . . . 0.0 109.88 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.531 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.5 mp0 -101.12 -1.87 32.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.417 -0.802 . . . . 0.0 110.518 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.01 140.95 29.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.181 -0.949 . . . . 0.0 110.492 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.13 127.62 40.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 109.853 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.773 ' C ' HD12 ' B' ' 44' ' ' ILE . 19.2 mt -104.58 118.17 35.92 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.93 . . . . 0.0 110.223 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.773 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.2 137.95 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.493 -0.755 . . . . 0.0 109.821 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.79 147.83 39.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.438 -0.789 . . . . 0.0 109.795 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 29.05 0.54 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.407 -0.808 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.435 ' HA3' HD21 ' A' ' 26' ' ' LEU . . . 78.13 6.01 87.41 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 110.621 -0.991 . . . . 0.0 110.621 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mtmm -110.96 134.44 52.58 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.054 -1.262 . . . . 0.0 110.293 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -78.38 131.07 36.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.866 . . . . 0.0 109.542 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.708 HD12 ' HB3' ' B' ' 43' ' ' LEU . 38.7 mt -83.65 135.55 34.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -93.5 132.88 37.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.396 -0.815 . . . . 0.0 110.578 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.452 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.2 m-20 -48.38 -26.29 2.0 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.588 -0.695 . . . . 0.0 111.165 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.8 -7.81 86.8 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.5 mmt-85 -99.54 154.23 18.41 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.266 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 23.3 p -102.4 164.18 11.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.374 -0.828 . . . . 0.0 110.174 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' B' ' 61' ' ' ILE . 92.8 mt -53.53 -43.35 68.29 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.266 -0.896 . . . . 0.0 110.671 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 13.2 t -56.81 -36.24 69.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.402 -0.811 . . . . 0.0 110.971 -179.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.62 -27.75 66.59 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.231 -0.918 . . . . 0.0 110.398 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.599 ' CG ' HD22 ' B' ' 50' ' ' LEU . 80.3 m-85 -100.92 25.83 7.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.228 -0.92 . . . . 0.0 110.068 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 50.65 30.31 4.8 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.589 HD13 HD21 ' B' ' 67' ' ' LEU . 90.9 mt -81.35 113.07 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.402 -0.811 . . . . 0.0 109.934 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -105.58 171.82 7.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.452 -0.78 . . . . 0.0 110.179 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 pttp -46.51 152.39 0.46 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.487 -0.758 . . . . 0.0 111.0 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 5.1 mt-10 62.74 16.35 8.9 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.693 -0.63 . . . . 0.0 110.639 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.05 49.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.041 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' THR . . . . . 0.564 HG21 ' OE2' ' A' ' 32' ' ' GLU . 25.3 m -107.62 111.1 23.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.344 -0.848 . . . . 0.0 109.977 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.589 HD21 HD13 ' B' ' 61' ' ' ILE . 1.3 mt -102.55 164.92 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.325 -0.86 . . . . 0.0 110.13 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.497 ' CD2' HG12 ' A' ' 28' ' ' VAL . 71.3 m80 -108.79 132.37 54.05 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.301 -0.874 . . . . 0.0 110.186 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.473 HD22 HD13 ' B' ' 30' ' ' ILE . 59.6 tp -107.3 131.4 54.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.346 -0.846 . . . . 0.0 110.255 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.62 HG13 HD11 ' B' ' 8' ' ' LEU . 39.5 t -124.88 152.53 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 89.0 mt -94.33 133.6 37.71 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.458 -0.776 . . . . 0.0 110.188 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 56.5 ttt-85 -86.68 135.84 33.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.342 -0.849 . . . . 0.0 110.236 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.2 mt -97.51 -175.55 3.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.807 . . . . 0.0 110.127 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -128.48 77.05 1.75 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.238 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 145.32 151.36 5.4 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 CA-C-O 118.009 -1.439 . . . . 0.0 109.522 -179.994 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 24.7 t60 . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.19 0.519 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.579 ' C ' HD12 ' A' ' 3' ' ' LEU . 4.6 mmm -128.6 175.42 8.58 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 0.0 110.305 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.579 HD12 ' C ' ' A' ' 2' ' ' MET . 10.6 mp -112.25 24.72 12.27 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.509 -0.744 . . . . 0.0 109.588 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.09 -30.76 41.09 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.7 mp -106.49 40.09 1.69 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.365 -1.08 . . . . 0.0 110.169 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.15 152.06 23.68 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.98 32.76 13.31 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.408 -1.054 . . . . 0.0 110.432 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.3 p 50.42 32.0 6.01 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.439 -0.788 . . . . 0.0 110.624 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.9 t0 52.2 30.51 7.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.453 -0.779 . . . . 0.0 110.533 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 57.95 104.94 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.29 -0.881 . . . . 0.0 110.348 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -98.16 82.24 2.91 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.29 -0.882 . . . . 0.0 110.244 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -154.84 43.27 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.31 -0.869 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.05 -52.73 0.79 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.34 -27.85 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.404 -1.057 . . . . 0.0 110.218 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -104.39 153.56 38.98 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.36 -0.837 . . . . 0.0 110.237 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.72 -16.16 29.98 Favored 'Trans proline' 0 C--N 1.309 -1.529 0 O-C-N 123.853 1.449 . . . . 0.0 110.753 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -10.35 59.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.281 -0.887 . . . . 0.0 110.541 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.36 8.71 38.12 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.129 -0.982 . . . . 0.0 110.533 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.54 119.2 0.57 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.187 -0.946 . . . . 0.0 109.743 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.39 -15.75 38.66 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 O-C-N 123.97 1.511 . . . . 0.0 110.154 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.647 ' HB2' HG13 ' B' ' 70' ' ' VAL . 14.8 pt-20 -75.21 -29.79 60.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.406 -0.809 . . . . 0.0 109.426 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 tp -89.46 -31.16 17.82 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.553 -0.717 . . . . 0.0 109.259 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.65 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.547 -0.721 . . . . 0.0 109.223 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.5 tp -76.58 -38.62 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.538 -0.726 . . . . 0.0 109.482 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.04 -29.75 71.07 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.394 -0.816 . . . . 0.0 109.53 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.693 HD21 ' O ' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -82.95 -21.28 34.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.591 -0.693 . . . . 0.0 110.211 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -84.25 -32.23 24.55 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.334 -0.854 . . . . 0.0 109.709 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.0 t -78.45 -38.2 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.451 -0.78 . . . . 0.0 109.907 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.3 m -72.86 -41.98 64.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.849 . . . . 0.0 109.903 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 20.9 ttt -62.3 -35.92 80.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.372 -0.83 . . . . 0.0 109.957 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -69.78 -36.71 75.96 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 109.945 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.19 -44.43 83.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.382 -0.824 . . . . 0.0 110.046 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -34.83 77.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.357 -0.839 . . . . 0.0 110.091 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -41.94 81.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.36 -0.838 . . . . 0.0 109.923 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.13 -33.44 70.87 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.472 -0.768 . . . . 0.0 109.9 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -47.05 13.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.386 -0.821 . . . . 0.0 109.97 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.695 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 6.7 tm0? -58.88 -32.67 69.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.845 . . . . 0.0 110.039 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -83.93 -57.78 3.06 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.475 -0.766 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.6 -34.72 52.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.471 -0.768 . . . . 0.0 109.327 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -81.78 -32.84 31.21 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.551 -0.718 . . . . 0.0 109.076 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.695 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -65.63 -45.17 84.1 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.694 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -76.79 -31.99 57.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.375 -0.828 . . . . 0.0 109.882 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -53.97 -41.27 67.67 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.328 -0.858 . . . . 0.0 109.333 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.72 40.25 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.14 -28.35 69.58 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.609 -0.682 . . . . 0.0 109.687 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.32 -46.87 9.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.498 -0.751 . . . . 0.0 110.025 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.79 -30.12 71.11 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 109.982 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.1 m -79.33 -40.99 28.96 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.401 -0.812 . . . . 0.0 110.285 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.12 66.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.393 -0.817 . . . . 0.0 110.291 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.38 30.98 2.35 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.321 -0.862 . . . . 0.0 110.251 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -147.1 -48.38 0.18 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.387 -0.82 . . . . 0.0 110.207 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -140.25 30.94 1.95 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.329 -0.857 . . . . 0.0 110.244 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -119.5 -66.86 0.29 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.8 pt -116.36 62.64 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.362 -1.081 . . . . 0.0 110.135 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.41 133.8 35.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.368 -0.832 . . . . 0.0 110.369 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 25.4 p -101.24 83.71 2.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.127 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 m -135.73 -47.44 0.68 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.33 -0.856 . . . . 0.0 110.211 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.75 87.53 0.1 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.1 t -117.18 55.09 0.85 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.45 -1.03 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.76 93.87 4.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.296 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.12 -60.63 1.73 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.142 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 m -119.49 74.75 1.02 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.367 -0.833 . . . . 0.0 110.062 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.94 -35.91 74.89 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.416 -0.803 . . . . 0.0 110.319 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.84 -32.08 57.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.252 -0.905 . . . . 0.0 109.29 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.28 82.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.49 -0.884 . . . . 0.0 108.784 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -70.51 -29.43 65.93 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.452 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.0 tt -76.88 -40.89 45.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.55 -0.719 . . . . 0.0 109.874 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HA ' HG22 ' A' ' 71' ' ' ILE . 4.0 tptt -82.97 -50.17 8.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.403 -0.811 . . . . 0.0 110.529 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.5 tpt -57.46 -40.59 78.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.6 m -69.72 -40.57 76.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.271 -0.893 . . . . 0.0 110.414 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.3 tp -83.66 -16.5 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 O-C-N 121.215 -0.928 . . . . 0.0 110.288 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -73.91 -42.03 61.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.252 -0.905 . . . . 0.0 109.782 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -81.51 -26.12 35.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.44 -0.787 . . . . 0.0 110.026 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -83.83 -48.14 10.37 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.444 -0.785 . . . . 0.0 110.237 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -65.26 -30.47 71.35 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.056 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -88.21 115.48 25.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.365 -0.834 . . . . 0.0 110.221 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.11 -59.91 0.06 OUTLIER Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.26 106.08 4.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.414 -1.05 . . . . 0.0 110.199 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.5 m -113.83 32.55 5.76 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.331 -0.856 . . . . 0.0 110.227 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.76 10.37 74.98 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 110.004 -1.239 . . . . 0.0 110.004 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.25 151.42 1.66 Allowed Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.136 -1.214 . . . . 0.0 108.94 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -76.77 37.95 0.6 Allowed 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 123.524 1.276 . . . . 0.0 110.762 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 50.72 47.26 24.75 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.129 -0.982 . . . . 0.0 110.632 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 tp -90.6 -27.15 19.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.198 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 80.4 p -58.68 -22.74 57.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.332 -0.855 . . . . 0.0 110.431 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -91.83 -26.96 18.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.295 -0.878 . . . . 0.0 110.189 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 32.1 mtt -69.36 121.59 17.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p -78.23 -164.59 0.56 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.423 -0.798 . . . . 0.0 110.435 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 pt-20 -66.1 -32.42 73.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.617 -0.677 . . . . 0.0 109.317 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.441 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.2 mp0 -85.3 -40.36 16.65 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.26 -41.43 99.04 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -71.14 -35.4 71.68 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.568 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.9 -38.7 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -34.42 78.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.455 -0.778 . . . . 0.0 109.736 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -80.0 -44.23 20.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.417 -0.802 . . . . 0.0 110.16 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.32 -31.7 67.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.294 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.557 ' HG3' HD12 ' A' ' 101' ' ' LEU . 56.2 tpp -82.54 -20.81 35.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.365 -0.835 . . . . 0.0 109.981 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -76.28 -38.82 55.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 110.096 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 79.9 mtp -84.79 -25.14 28.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.393 -0.817 . . . . 0.0 110.292 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -79.5 -33.35 42.24 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.285 -0.884 . . . . 0.0 110.325 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.557 HD12 ' HG3' ' A' ' 97' ' ' MET . 14.6 mt -76.38 -35.49 58.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.3 -0.875 . . . . 0.0 110.276 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 41.5 mm-40 -107.65 36.18 2.83 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.231 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -114.34 -133.12 5.53 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.588 ' HB1' ' CG ' ' A' ' 108' ' ' GLN . . . -128.18 67.95 1.35 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.304 -1.115 . . . . 0.0 110.22 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.23 32.38 4.48 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.34 -0.85 . . . . 0.0 110.103 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -166.11 83.0 0.3 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -0.847 . . . . 0.0 110.258 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.46 -30.47 2.69 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.588 ' CG ' ' HB1' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -145.82 69.74 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.424 -1.044 . . . . 0.0 110.273 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.74 -62.41 0.11 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.289 -0.882 . . . . 0.0 110.255 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -85.92 -28.75 24.12 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.31 -0.869 . . . . 0.0 110.25 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 28.5 t -73.09 -39.38 65.86 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.395 -0.816 . . . . 0.0 110.208 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.248 179.974 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.438 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.153 0.501 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -87.65 140.42 29.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.371 -0.831 . . . . 0.0 109.882 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.1 pt -137.64 159.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -0.859 . . . . 0.0 110.614 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.406 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 81.1 m-85 -111.96 142.19 44.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.647 -0.658 . . . . 0.0 110.551 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.3 t -128.17 125.08 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.431 -0.793 . . . . 0.0 109.723 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.23 130.12 46.32 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.439 -0.788 . . . . 0.0 110.514 -179.652 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.595 HG22 HD23 ' B' ' 69' ' ' LEU . 19.7 p -95.79 177.66 5.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.44 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -16.19 42.18 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.431 -0.793 . . . . 0.0 111.007 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.9 19.59 11.24 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.038 -1.039 . . . . 0.0 110.693 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.9 12.8 58.17 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.2 OUTLIER -84.92 133.37 34.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.073 -1.251 . . . . 0.0 109.825 179.624 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.423 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 10.3 m -113.21 125.59 54.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 16.2 mt -109.13 136.67 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.384 -0.823 . . . . 0.0 110.466 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.406 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 11.4 m -102.19 118.52 37.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.412 -0.805 . . . . 0.0 109.222 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.0 mt -123.27 165.29 17.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.137 -0.977 . . . . 0.0 110.883 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -106.35 117.12 33.21 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.381 -0.825 . . . . 0.0 109.743 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.546 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.4 m -140.42 176.21 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.331 -0.856 . . . . 0.0 110.712 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.561 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.8 mp0 -113.06 163.86 16.98 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.571 -0.706 . . . . 0.0 109.137 178.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.06 -27.17 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.507 1.267 . . . . 0.0 110.332 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.3 p -84.71 -3.11 58.4 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.099 -1.0 . . . . 0.0 110.704 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -71.38 140.08 50.02 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.097 -1.002 . . . . 0.0 110.687 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.43 161.37 21.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.551 -0.718 . . . . 0.0 110.371 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 1.081 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.14 -34.03 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.733 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -60.61 -37.76 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -0.941 . . . . 0.0 109.339 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -31.24 68.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.445 -0.784 . . . . 0.0 109.425 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 88.3 t -70.28 -42.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.411 -0.806 . . . . 0.0 109.38 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.501 ' HE3' HG22 ' B' ' 23' ' ' ILE . 34.8 mttt -63.0 -41.77 99.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.474 -0.766 . . . . 0.0 109.251 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -35.22 76.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.446 -0.784 . . . . 0.0 109.282 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.546 ' CD ' HG12 ' B' ' 17' ' ' VAL . 8.4 mttm -68.3 -38.18 81.37 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 109.661 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.6 mt -67.3 -40.31 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.103 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.52 -49.63 76.79 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.449 -0.782 . . . . 0.0 109.462 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.12 -26.53 62.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.326 -0.859 . . . . 0.0 110.314 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -83.91 -41.24 17.62 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.406 -0.809 . . . . 0.0 110.739 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.06 -56.1 2.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.264 -0.898 . . . . 0.0 110.417 -179.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.57 19.57 1.65 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.504 HG23 ' HD2' ' B' ' 37' ' ' PRO . 22.6 mt -91.31 143.89 28.95 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.061 -1.258 . . . . 0.0 109.644 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.504 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.3 Cg_endo -68.2 133.64 29.18 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.614 1.323 . . . . 0.0 110.482 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.77 -23.81 77.35 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.79 1.416 . . . . 0.0 110.991 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.82 -23.77 64.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.252 -0.905 . . . . 0.0 109.762 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.503 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.38 0.63 40.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.428 -0.795 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -94.22 137.61 33.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.198 -0.939 . . . . 0.0 110.407 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -130.12 132.01 45.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 1.081 HD12 HG23 ' B' ' 23' ' ' ILE . 39.2 mt -104.79 118.03 35.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.398 -0.814 . . . . 0.0 110.673 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.78 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.33 133.41 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.5 -0.75 . . . . 0.0 109.797 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 11.4 t80 -141.25 155.54 46.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.397 -0.814 . . . . 0.0 109.977 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.426 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 44.7 24.75 0.11 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.424 -0.797 . . . . 0.0 111.558 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.693 ' O ' HD21 ' A' ' 26' ' ' LEU . . . 84.8 -8.86 67.56 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.119 -1.039 . . . . 0.0 110.851 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' B' ' 45' ' ' PHE . 9.2 ptmt -110.69 142.14 43.0 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.809 -1.406 . . . . 0.0 110.484 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.4 137.26 37.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.346 -0.846 . . . . 0.0 109.908 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.797 HD22 ' CG ' ' B' ' 59' ' ' TYR . 24.9 mt -83.79 148.84 26.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.333 -0.854 . . . . 0.0 110.346 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -93.48 130.25 39.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.298 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.56 -28.13 3.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.494 -0.754 . . . . 0.0 111.079 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 -3.05 90.66 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.405 ' O ' HD13 ' B' ' 23' ' ' ILE . 12.2 mmt180 -99.49 155.99 17.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.126 -1.22 . . . . 0.0 110.346 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.55 163.19 12.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.388 -0.82 . . . . 0.0 110.182 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.581 ' HA ' HD12 ' B' ' 61' ' ' ILE . 85.9 mt -53.24 -45.74 68.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.281 -0.887 . . . . 0.0 110.574 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.5 t -56.93 -35.89 69.58 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.415 -0.803 . . . . 0.0 110.838 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -59.6 -29.43 67.97 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.307 -0.871 . . . . 0.0 110.44 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.797 ' CG ' HD22 ' B' ' 50' ' ' LEU . 41.8 m-85 -101.07 28.48 5.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.352 -0.843 . . . . 0.0 109.977 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 26.2 m-20 50.7 28.23 3.45 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.512 -0.743 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.702 HD13 HD21 ' B' ' 67' ' ' LEU . 88.0 mt -81.47 110.19 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.394 -0.816 . . . . 0.0 109.876 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -105.62 172.48 6.77 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.282 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.3 pttt -46.62 151.97 0.52 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.477 -0.765 . . . . 0.0 110.995 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 4.0 mm-40 62.76 15.94 8.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.783 -0.573 . . . . 0.0 110.623 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.61 145.23 49.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.929 . . . . 0.0 110.162 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 39.8 m -107.76 109.78 21.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.842 . . . . 0.0 110.082 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.702 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.29 161.58 13.58 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.345 -0.847 . . . . 0.0 110.043 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -108.64 132.01 54.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 109.909 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.595 HD23 HG22 ' B' ' 7' ' ' THR . 32.9 tp -107.05 136.09 47.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.318 -0.864 . . . . 0.0 110.165 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.647 HG13 ' HB2' ' A' ' 21' ' ' GLU . 21.3 t -124.77 149.68 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.862 . . . . 0.0 109.953 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 60.1 mt -94.35 119.05 32.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.496 -0.752 . . . . 0.0 110.22 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.435 ' HB2' ' HA ' ' B' ' 40' ' ' GLN . 0.0 OUTLIER -75.84 85.46 2.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.315 -0.866 . . . . 0.0 110.149 179.903 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 mt -60.65 111.25 1.54 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.432 -0.793 . . . . 0.0 110.246 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -104.33 86.0 2.46 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.16 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -168.87 -102.48 0.16 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 118.011 -1.439 . . . . 0.0 109.537 179.994 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.226 0.536 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 6.7 mmm -143.48 -176.07 4.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.357 -0.839 . . . . 0.0 110.102 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.571 ' O ' HD12 ' A' ' 3' ' ' LEU . 2.5 pp -110.3 18.88 19.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.46 -0.775 . . . . 0.0 109.847 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.42 66.13 3.73 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.57 14.91 19.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 110.492 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.11 32.6 0.16 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.25 -47.33 9.53 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.288 -1.125 . . . . 0.0 110.183 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 93.3 p -101.29 31.37 3.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -0.841 . . . . 0.0 110.22 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.21 -23.56 24.72 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.333 -0.854 . . . . 0.0 110.388 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.575 ' HB2' HG12 ' A' ' 14' ' ' VAL . 40.2 p90 -162.56 122.23 2.32 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.28 -0.887 . . . . 0.0 110.3 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -166.53 34.45 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.849 . . . . 0.0 110.271 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -170.42 -39.95 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.312 -0.868 . . . . 0.0 110.459 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -102.65 8.37 54.56 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.575 HG12 ' HB2' ' A' ' 10' ' ' PHE . 34.4 m -60.56 -35.4 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.087 -1.243 . . . . 0.0 110.263 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.404 ' N ' HG23 ' A' ' 14' ' ' VAL . 1.9 m-20 -97.54 156.21 36.39 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.502 -0.749 . . . . 0.0 110.218 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.47 -16.58 30.75 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 O-C-N 123.741 1.39 . . . . 0.0 110.808 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.81 -10.74 60.16 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.232 -0.917 . . . . 0.0 110.541 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.82 1.42 50.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.159 -0.963 . . . . 0.0 110.739 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -168.05 117.23 0.65 Allowed Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.128 -0.983 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -70.09 -14.58 35.21 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 123.918 1.483 . . . . 0.0 110.03 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.687 ' HB3' HG11 ' B' ' 70' ' ' VAL . 16.6 mt-10 -74.46 -34.09 63.06 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 109.333 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 22' ' ' LEU . 16.4 mt -82.48 -29.44 30.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.628 -0.67 . . . . 0.0 109.326 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.31 -34.34 65.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.453 -0.779 . . . . 0.0 109.551 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.661 ' O ' HG23 ' A' ' 28' ' ' VAL . 5.3 mt -81.89 -32.86 30.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.408 -0.808 . . . . 0.0 109.566 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' B' ' 44' ' ' ILE . . . -66.51 -32.65 74.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.475 -0.766 . . . . 0.0 109.798 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.43 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -82.74 -24.99 33.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.382 -0.824 . . . . 0.0 110.229 179.771 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.79 -26.95 29.18 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.663 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 24' ' ' LEU . 83.1 t -85.76 -40.62 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.46 -0.775 . . . . 0.0 109.984 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 m -69.76 -38.75 76.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -43.65 66.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.268 -0.895 . . . . 0.0 110.131 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.74 -37.51 86.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.397 -0.815 . . . . 0.0 109.939 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.01 -42.51 76.31 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.823 . . . . 0.0 110.022 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.95 -32.2 73.8 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 110.061 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -42.57 84.02 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.332 -0.855 . . . . 0.0 109.933 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -31.14 71.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.327 -0.858 . . . . 0.0 109.91 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -40.96 24.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.065 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.571 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.2 tp60 -73.62 -21.79 60.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.432 -0.793 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -83.76 -53.73 5.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.382 -0.824 . . . . 0.0 109.542 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.65 -29.26 51.91 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.313 -0.867 . . . . 0.0 109.102 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -89.91 -35.82 15.38 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.645 -0.659 . . . . 0.0 109.888 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.96 -38.79 79.61 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 110.163 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -78.33 -34.79 48.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.789 . . . . 0.0 110.186 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp85 -59.32 -40.62 86.86 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -0.89 . . . . 0.0 109.835 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.88 -29.33 60.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.47 -0.769 . . . . 0.0 109.779 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.11 -26.98 59.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.427 -0.795 . . . . 0.0 110.076 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.85 -43.96 17.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.392 -0.817 . . . . 0.0 110.148 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.93 -32.99 65.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.31 -0.869 . . . . 0.0 110.11 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -77.04 -44.09 32.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.379 -0.826 . . . . 0.0 110.106 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.24 -28.58 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.12 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.47 26.84 4.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.428 -0.795 . . . . 0.0 110.123 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -145.0 -49.06 0.24 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.3 -0.875 . . . . 0.0 110.013 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -117.55 22.93 12.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.382 -0.823 . . . . 0.0 110.255 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -166.71 41.09 0.26 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.8 tp -64.58 -23.88 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.321 -1.105 . . . . 0.0 110.223 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.72 69.73 1.12 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.305 -0.872 . . . . 0.0 110.166 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.4 p -86.15 135.13 33.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.336 -0.853 . . . . 0.0 110.244 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.545 HG23 ' O ' ' A' ' 57' ' ' THR . 9.9 t -81.52 121.84 26.8 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.398 -0.813 . . . . 0.0 110.291 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.24 -81.62 0.04 OUTLIER Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.394 -1.483 . . . . 0.0 109.394 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.6 p -128.36 92.19 3.39 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.434 -1.039 . . . . 0.0 110.093 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -105.31 67.57 0.78 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.468 -0.77 . . . . 0.0 110.193 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.35 -42.09 14.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.35 -0.844 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 m -92.6 70.88 4.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.343 -0.848 . . . . 0.0 110.126 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -56.75 -29.53 62.65 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.326 -0.859 . . . . 0.0 110.253 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.31 -30.13 57.6 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.222 -0.924 . . . . 0.0 109.119 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.883 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mp -64.99 -29.06 69.96 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 tt -76.44 -37.57 56.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 0.0 109.769 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.435 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.8 OUTLIER -83.51 -55.84 4.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.297 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.2 tpt -52.12 -45.35 64.91 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.203 -0.936 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.0 m -66.22 -42.64 88.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.343 -0.848 . . . . 0.0 110.474 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.435 HG22 ' HA ' ' A' ' 68' ' ' LYS . 4.5 tp -82.78 -6.39 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 0.0 110.368 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -82.26 -46.68 13.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 110.044 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -83.74 -20.88 32.6 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.362 -0.836 . . . . 0.0 110.433 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -88.51 -40.26 13.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.465 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.4 tm-20 -75.3 -36.05 61.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.268 -0.895 . . . . 0.0 110.367 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -64.25 -75.23 0.09 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.311 -0.868 . . . . 0.0 110.201 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.82 -80.87 0.06 OUTLIER Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -154.96 71.61 0.8 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.381 -1.07 . . . . 0.0 110.123 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -53.28 -25.34 14.26 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.401 -0.812 . . . . 0.0 109.775 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.442 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 141.73 -102.42 0.3 Allowed Glycine 0 N--CA 1.487 2.051 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.489 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER 179.61 53.65 0.05 OUTLIER Pre-proline 0 C--N 1.308 -1.213 0 O-C-N 121.547 -0.973 . . . . 0.0 108.959 179.717 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 81' ' ' LEU . 43.1 Cg_endo -69.2 -8.47 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.978 1.515 . . . . 0.0 108.591 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -65.31 83.75 0.05 Allowed 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.164 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mt -81.59 -25.22 35.94 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.444 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.4 m -60.35 -18.85 52.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.31 -0.869 . . . . 0.0 110.671 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.7 m -113.15 22.42 14.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 0.0 110.085 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.2 mtt -102.33 123.12 45.56 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.0 110.173 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 74.7 p -74.55 -166.29 0.43 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 110.38 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.527 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.0 pt-20 -68.61 -28.85 67.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.582 -0.699 . . . . 0.0 109.279 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.437 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 33.6 mt-10 -85.61 -40.68 15.97 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 179.03 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -64.85 -43.71 92.13 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -66.74 -34.12 77.13 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.527 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.41 -35.75 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -38.44 91.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.486 -0.759 . . . . 0.0 109.485 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.68 -42.54 64.17 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.94 92.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.46 -0.775 . . . . 0.0 110.018 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 34.6 mmm -75.53 -22.41 57.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.419 -0.801 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -49.22 70.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.545 -0.722 . . . . 0.0 109.902 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 31.0 mtm -70.27 -30.96 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.767 . . . . 0.0 110.077 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -25.73 61.99 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.443 -0.786 . . . . 0.0 110.12 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.5 mt -91.75 -9.73 42.59 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.383 -0.823 . . . . 0.0 110.664 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -55.89 -26.1 45.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.366 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.81 38.44 3.09 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -155.92 81.46 1.01 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.324 -1.103 . . . . 0.0 110.219 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -103.95 -47.05 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 110.243 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.34 -68.15 0.93 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.174 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.97 47.47 0.26 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.436 -1.465 . . . . 0.0 109.436 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.94 103.1 6.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.341 -1.093 . . . . 0.0 110.118 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -126.87 43.26 3.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.82 . . . . 0.0 110.213 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.14 28.38 4.06 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.049 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.58 -35.46 4.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.439 -0.788 . . . . 0.0 110.198 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.204 0.526 . . . . 0.0 110.35 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.67 134.42 47.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.409 -0.807 . . . . 0.0 109.555 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 13.2 pt -136.9 155.6 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 109.943 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -111.64 144.28 41.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.559 -0.713 . . . . 0.0 111.04 -179.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.2 t -127.82 117.77 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.476 -0.765 . . . . 0.0 109.262 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.29 133.95 43.95 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.507 -0.746 . . . . 0.0 110.894 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 72.1 p -96.4 172.08 8.17 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 39.7 mt -61.7 -11.58 12.57 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.405 -0.809 . . . . 0.0 111.017 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.4 p -95.61 0.22 52.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.015 -1.053 . . . . 0.0 110.909 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.46 9.11 67.26 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.5 tttp -84.61 126.09 33.04 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.089 -1.242 . . . . 0.0 109.859 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.0 m -112.97 123.39 50.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.303 -0.873 . . . . 0.0 110.284 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.404 HD13 HG21 ' B' ' 13' ' ' ILE . 17.9 mt -109.23 136.58 44.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.534 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.5 m -102.25 119.47 38.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.432 -0.792 . . . . 0.0 109.377 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.69 162.42 23.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.149 -0.969 . . . . 0.0 111.023 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.438 ' HA ' ' O ' ' B' ' 1' ' ' MET . 3.4 mm-40 -106.32 118.89 37.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.542 -0.724 . . . . 0.0 109.262 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.4 m -140.4 178.65 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.157 -0.964 . . . . 0.0 111.333 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.489 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.2 mm-40 -113.57 159.8 34.1 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -73.69 -24.95 15.25 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 O-C-N 123.403 1.212 . . . . 0.0 110.041 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.8 -4.62 59.15 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.241 -0.912 . . . . 0.0 110.328 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -71.14 144.99 50.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.176 -0.952 . . . . 0.0 110.573 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 71.8 p -83.25 158.24 22.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.484 -0.76 . . . . 0.0 110.329 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.525 ' CG2' HD12 ' B' ' 43' ' ' LEU . 46.0 mm -59.75 -32.31 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.841 . . . . 0.0 109.505 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.73 -36.96 84.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.421 -0.799 . . . . 0.0 109.251 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.3 -32.01 69.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.506 -0.746 . . . . 0.0 109.162 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' VAL . . . . . 0.427 HG21 HD21 ' B' ' 56' ' ' LEU . 58.4 t -70.13 -41.18 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.466 -0.771 . . . . 0.0 109.223 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -62.96 -41.64 99.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 109.151 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.57 -34.4 75.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.744 . . . . 0.0 109.422 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -68.03 -39.01 83.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.459 179.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.0 mt -66.94 -38.73 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.315 -0.866 . . . . 0.0 109.098 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -49.56 77.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.448 -0.782 . . . . 0.0 109.457 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.24 -27.21 63.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.516 -0.74 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.82 -40.94 18.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.252 -0.905 . . . . 0.0 110.875 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -108.04 -55.78 2.32 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.253 -0.904 . . . . 0.0 110.419 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.08 18.72 1.66 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.483 HG23 ' HD2' ' B' ' 37' ' ' PRO . 80.8 mt -91.38 143.12 27.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.13 -1.217 . . . . 0.0 109.944 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.483 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.8 Cg_endo -69.98 133.73 25.85 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 O-C-N 123.542 1.285 . . . . 0.0 110.492 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.81 -26.69 83.52 Favored 'Trans proline' 0 C--N 1.313 -1.321 0 O-C-N 123.618 1.325 . . . . 0.0 110.949 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.76 -24.25 64.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.357 -0.839 . . . . 0.0 109.968 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.432 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 28.8 mm-40 -101.43 0.59 37.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.288 -0.882 . . . . 0.0 110.441 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -94.38 140.25 30.05 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.14 -0.975 . . . . 0.0 110.447 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -130.14 128.43 41.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.453 -0.779 . . . . 0.0 109.797 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.905 ' HB3' HD12 ' B' ' 50' ' ' LEU . 32.5 mt -104.68 118.97 37.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.322 -0.861 . . . . 0.0 110.522 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.653 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.6 mp -121.36 135.98 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.506 -0.746 . . . . 0.0 109.922 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -140.83 151.2 44.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.468 -0.77 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.37 28.27 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.511 -0.743 . . . . 0.0 111.195 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.54 1.44 76.64 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.01 137.67 48.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.07 -1.253 . . . . 0.0 110.175 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -78.33 139.13 38.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.258 -0.902 . . . . 0.0 109.998 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.905 HD12 ' HB3' ' B' ' 43' ' ' LEU . 55.1 mt -83.89 143.45 29.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.333 -0.855 . . . . 0.0 110.348 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.62 126.52 38.83 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.505 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.463 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.8 p30 -48.69 -29.73 4.75 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.444 -0.785 . . . . 0.0 111.132 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -6.15 88.69 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -99.47 158.6 15.62 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.025 -1.279 . . . . 0.0 110.388 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.5 p -102.06 164.12 11.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.438 -0.789 . . . . 0.0 110.288 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.61 ' HA ' HD12 ' B' ' 61' ' ' ILE . 92.9 mt -53.86 -45.7 71.04 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.341 -0.849 . . . . 0.0 110.751 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 55.4 p -56.58 -34.17 66.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.303 -0.873 . . . . 0.0 111.198 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -59.52 -27.65 66.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.094 -1.004 . . . . 0.0 110.374 -179.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.475 ' CG ' HD22 ' B' ' 50' ' ' LEU . 70.5 m-85 -101.12 27.02 6.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.857 . . . . 0.0 109.983 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.92 32.35 7.28 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.61 HD12 ' HA ' ' B' ' 56' ' ' LEU . 97.7 mt -81.56 108.91 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.286 -0.884 . . . . 0.0 109.869 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -105.64 173.67 6.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.374 -0.829 . . . . 0.0 110.346 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.4 ptmt -46.62 152.1 0.5 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.59 -0.694 . . . . 0.0 111.17 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.3 mm-40 62.84 15.47 8.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.792 -0.568 . . . . 0.0 110.841 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.64 139.17 49.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -107.37 111.05 23.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.927 . . . . 0.0 110.03 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.444 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mp -102.29 164.0 11.92 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.28 -0.888 . . . . 0.0 110.022 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -108.88 130.7 55.43 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 109.996 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 tp -107.19 133.67 51.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.883 . . . . 0.0 110.286 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.687 HG11 ' HB3' ' A' ' 21' ' ' GLU . 27.7 t -124.87 151.59 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.405 -0.809 . . . . 0.0 109.958 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.28 91.46 6.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.319 -0.863 . . . . 0.0 110.274 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -73.38 83.39 1.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.376 -0.828 . . . . 0.0 110.18 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 5.0 mt -88.54 159.18 18.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 110.148 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.3 mmm-85 51.67 55.5 9.27 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.377 -0.827 . . . . 0.0 110.385 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -152.35 -49.56 0.02 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.033 -1.426 . . . . 0.0 109.559 -179.921 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 20.2 p80 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.183 0.516 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mmm -76.93 -178.69 5.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.387 -0.821 . . . . 0.0 110.134 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.651 ' HA ' ' HB2' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -112.15 24.51 12.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.389 -0.819 . . . . 0.0 109.621 179.547 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.89 -82.19 0.86 Allowed Glycine 0 N--CA 1.487 2.078 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.5 tp -102.8 -32.24 9.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.359 -1.083 . . . . 0.0 110.182 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -94.17 82.14 0.97 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.651 ' HB2' ' HA ' ' A' ' 3' ' ' LEU . . . -167.11 110.02 0.69 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.428 -1.042 . . . . 0.0 110.188 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.0 m 52.17 25.49 3.33 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.31 -0.869 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -101.98 -18.23 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.317 -0.864 . . . . 0.0 110.273 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.4 62.36 1.11 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.309 -0.869 . . . . 0.0 110.131 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.22 92.86 3.88 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.223 -0.923 . . . . 0.0 110.096 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -154.66 -73.34 0.12 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.377 -0.827 . . . . 0.0 110.279 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -129.76 30.85 3.49 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.706 -1.358 . . . . 0.0 109.706 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.435 HG13 ' N ' ' A' ' 15' ' ' ASP . 12.3 p -125.14 -36.27 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.278 -1.13 . . . . 0.0 110.321 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.435 ' N ' HG13 ' A' ' 14' ' ' VAL . 2.9 m-20 -124.22 144.1 44.59 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.296 -0.878 . . . . 0.0 110.147 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 -12.9 29.97 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.696 1.366 . . . . 0.0 110.795 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.5 m -72.65 -7.93 52.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.653 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -86.41 -21.2 27.27 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.47 120.57 0.61 Allowed Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.281 -0.887 . . . . 0.0 109.765 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.31 -15.63 38.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 123.914 1.481 . . . . 0.0 110.129 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.638 ' HB3' HG11 ' B' ' 70' ' ' VAL . 13.8 mt-10 -75.52 -31.74 60.25 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.803 . . . . 0.0 109.398 179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 22' ' ' LEU . 4.4 mm? -83.76 -29.4 27.47 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.601 -0.687 . . . . 0.0 109.361 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.69 -37.4 67.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.505 -0.747 . . . . 0.0 109.445 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.743 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.2 mm? -78.96 -33.69 45.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.501 ' HB1' HG21 ' B' ' 44' ' ' ILE . . . -68.74 -35.23 76.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.42 -0.8 . . . . 0.0 109.841 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -78.12 -22.67 48.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.452 -0.78 . . . . 0.0 110.088 179.795 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.16 -27.25 28.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.332 -0.855 . . . . 0.0 109.45 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.743 HG23 ' O ' ' A' ' 24' ' ' LEU . 68.5 t -82.4 -45.76 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.52 -0.737 . . . . 0.0 109.795 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -65.75 -41.36 92.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.336 -0.853 . . . . 0.0 110.022 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 tpp -64.17 -48.88 74.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.447 -0.783 . . . . 0.0 110.044 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -61.86 -40.09 94.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.449 -0.782 . . . . 0.0 110.101 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -62.6 -51.34 67.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.388 -0.82 . . . . 0.0 110.058 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -30.11 70.97 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.305 -0.872 . . . . 0.0 109.953 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -44.46 85.07 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.354 -0.841 . . . . 0.0 109.977 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -61.74 -36.55 81.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.356 -0.84 . . . . 0.0 110.055 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -42.6 32.14 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.36 -0.838 . . . . 0.0 109.865 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.676 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 35.3 mm-40 -69.14 -29.71 67.81 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.43 -0.794 . . . . 0.0 110.035 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.96 -57.13 3.32 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.519 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.69 -33.37 47.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.515 -0.741 . . . . 0.0 109.217 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.87 -34.23 24.64 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.577 -0.702 . . . . 0.0 109.14 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.676 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.54 -51.51 65.13 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.443 -0.786 . . . . 0.0 109.659 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.42 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 10.3 ptt180 -64.5 -32.47 74.11 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.342 -0.849 . . . . 0.0 109.673 179.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.77 -42.39 68.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.407 -0.808 . . . . 0.0 109.135 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.6 -28.54 45.77 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.42 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -63.2 -29.35 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.535 -0.728 . . . . 0.0 109.636 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.12 -41.77 15.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.05 74.92 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.298 -0.876 . . . . 0.0 110.032 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.5 t -77.96 -34.22 51.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.405 -0.809 . . . . 0.0 110.179 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.24 68.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.167 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.24 -25.49 51.64 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.393 -0.817 . . . . 0.0 110.204 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 93.79 5.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.258 -0.902 . . . . 0.0 110.241 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.52 27.06 4.68 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.25 -0.906 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -103.32 -44.44 1.71 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.2 pt -109.38 38.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.334 -1.098 . . . . 0.0 110.179 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.0 -42.9 13.6 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.253 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.2 p -90.04 57.3 3.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.193 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 t -166.15 145.74 6.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.352 -0.843 . . . . 0.0 110.239 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.46 44.2 0.21 Allowed Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.1 p -130.53 74.92 1.62 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.375 -1.073 . . . . 0.0 110.204 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -87.01 61.38 6.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.269 -0.895 . . . . 0.0 110.178 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.78 -40.47 95.31 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 110.199 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.99 71.73 3.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.416 -0.803 . . . . 0.0 110.148 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -76.81 -55.55 5.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.388 -0.82 . . . . 0.0 110.226 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -74.6 -28.13 60.77 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.183 -0.948 . . . . 0.0 109.161 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.93 97.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.931 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.29 -29.2 69.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.1 tt -75.17 -43.46 52.1 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.482 -0.762 . . . . 0.0 109.891 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.423 -0.798 . . . . 0.0 110.482 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -39.87 61.48 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.144 -0.972 . . . . 0.0 110.671 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.7 m -69.43 -41.31 76.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.299 -0.876 . . . . 0.0 110.453 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.2 tp -82.18 -16.4 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.114 -0.991 . . . . 0.0 110.134 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -74.61 -33.74 62.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.3 -0.875 . . . . 0.0 109.748 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -27.71 23.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.469 -0.77 . . . . 0.0 109.93 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.6 -45.19 11.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.338 -0.851 . . . . 0.0 110.207 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -34.03 69.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.33 -0.856 . . . . 0.0 110.127 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -92.29 47.39 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.41 -0.806 . . . . 0.0 110.172 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.63 -36.01 1.48 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.99 113.31 25.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -1.108 . . . . 0.0 110.273 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.9 m -153.78 27.47 0.49 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.436 -0.79 . . . . 0.0 110.219 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.45 28.01 16.85 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.02 146.95 1.46 Allowed Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.266 -1.137 . . . . 0.0 109.005 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.07 61.27 3.19 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.47 1.247 . . . . 0.0 110.31 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -72.04 89.18 1.11 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.532 -0.73 . . . . 0.0 110.246 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 84' ' ' LEU . 2.3 mm? -62.42 -28.54 69.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.422 -0.799 . . . . 0.0 110.142 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.6 m -70.08 -20.94 63.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.416 -0.802 . . . . 0.0 110.39 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -108.85 9.48 26.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.239 -0.913 . . . . 0.0 110.413 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 30.3 mtp -107.23 122.27 46.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.216 -0.927 . . . . 0.0 110.038 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.1 p -77.31 -165.05 0.53 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.465 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.572 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.9 pt-20 -67.14 -31.29 71.63 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.543 -0.723 . . . . 0.0 109.175 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.455 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.9 OUTLIER -85.48 -40.75 16.03 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.989 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -42.56 99.75 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -69.8 -35.92 75.24 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 178.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.572 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.76 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.798 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.67 72.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.541 -0.724 . . . . 0.0 109.802 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.21 -52.7 7.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.481 -0.762 . . . . 0.0 110.09 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.0 -33.09 74.94 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.4 -0.812 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.2 ttm -80.2 -21.52 42.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 109.824 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -73.69 -29.65 62.41 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.422 -0.799 . . . . 0.0 110.071 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.8 -28.59 21.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.464 -0.773 . . . . 0.0 110.184 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.78 -31.65 61.82 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.858 . . . . 0.0 110.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.42 14.28 17.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.436 -0.79 . . . . 0.0 110.41 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.62 -25.98 50.22 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.209 -0.932 . . . . 0.0 110.17 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 117.84 38.37 0.83 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -77.06 65.68 2.74 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.36 -1.082 . . . . 0.0 110.198 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.22 -38.22 43.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.151 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -162.55 55.37 0.22 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.455 -0.778 . . . . 0.0 110.065 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.34 85.72 0.71 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -151.39 96.5 2.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.373 -1.074 . . . . 0.0 110.226 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.55 44.31 0.08 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.341 -0.85 . . . . 0.0 110.161 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -124.37 53.91 1.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.378 -0.826 . . . . 0.0 110.179 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.9 t -132.66 15.48 4.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.301 -0.875 . . . . 0.0 110.473 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.182 179.959 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.26 0.552 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' GLN . . . . . 0.443 ' HG2' HG22 ' B' ' 14' ' ' THR . 0.4 OUTLIER -97.24 145.38 26.12 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.502 -0.749 . . . . 0.0 109.903 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 12.7 pt -137.65 159.47 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.344 -0.848 . . . . 0.0 110.17 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -111.85 142.82 43.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.582 -0.699 . . . . 0.0 110.754 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -127.76 118.16 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.476 -0.765 . . . . 0.0 109.503 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 30.2 mttt -100.25 135.19 42.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 110.607 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -96.04 170.04 9.56 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.454 -0.779 . . . . 0.0 110.189 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.693 HD11 HG13 ' B' ' 70' ' ' VAL . 8.3 mt -61.82 -9.27 6.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.459 -0.776 . . . . 0.0 111.203 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.9 p -95.27 -13.34 24.94 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.081 -1.012 . . . . 0.0 110.564 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 6.16 40.26 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.238 -1.145 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 56.7 tttt -84.61 128.56 34.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.113 -1.228 . . . . 0.0 110.049 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.8 m -113.23 125.21 54.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.303 -0.873 . . . . 0.0 110.08 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.4 mt -109.12 135.13 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.439 -0.788 . . . . 0.0 110.522 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.443 HG22 ' HG2' ' B' ' 2' ' ' GLN . 3.1 m -102.43 118.0 35.93 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.516 -0.74 . . . . 0.0 109.26 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -123.38 166.45 15.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.156 -0.965 . . . . 0.0 110.821 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.5 115.11 29.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.441 -0.787 . . . . 0.0 109.528 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.441 HG12 ' CD ' ' B' ' 29' ' ' LYS . 21.5 m -140.51 170.26 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.282 -0.886 . . . . 0.0 110.823 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -112.7 164.62 14.95 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.586 -0.696 . . . . 0.0 109.185 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -70.94 -25.51 23.04 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.569 1.3 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.36 -3.93 58.58 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.444 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -71.31 143.6 50.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.559 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.6 p -83.21 156.66 23.06 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.547 -0.72 . . . . 0.0 110.446 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 31.4 mm -59.67 -34.77 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.383 -0.823 . . . . 0.0 109.616 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.74 -36.92 82.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.34 -0.85 . . . . 0.0 109.33 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.2 -32.21 70.02 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.353 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.36 -39.2 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.451 -0.78 . . . . 0.0 109.049 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -63.14 -43.78 97.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.103 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.05 73.13 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.463 -0.773 . . . . 0.0 109.469 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.441 ' CD ' HG12 ' B' ' 17' ' ' VAL . 19.6 mttm -68.07 -40.26 82.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.495 -0.753 . . . . 0.0 109.543 179.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.423 HD13 HD22 ' B' ' 69' ' ' LEU . 18.0 mt -67.1 -37.14 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.586 -0.845 . . . . 0.0 109.03 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -60.83 -52.72 63.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.474 -0.767 . . . . 0.0 109.644 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -27.46 63.7 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.712 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -84.0 -39.93 19.07 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.198 -0.939 . . . . 0.0 111.037 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -108.15 -54.19 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.278 -0.889 . . . . 0.0 110.512 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.81 16.64 2.19 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.264 -1.135 . . . . 0.0 110.264 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.495 HG23 ' HD2' ' B' ' 37' ' ' PRO . 93.5 mt -91.2 143.51 28.48 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.077 -1.249 . . . . 0.0 109.778 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.495 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -69.49 133.88 27.17 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.66 1.347 . . . . 0.0 110.556 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.83 -26.43 83.05 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.741 1.39 . . . . 0.0 110.81 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.78 -25.65 64.81 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.341 -0.85 . . . . 0.0 109.902 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.448 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 58.8 mm-40 -101.26 4.36 41.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.35 -0.844 . . . . 0.0 110.464 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.22 139.32 31.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.238 -0.914 . . . . 0.0 110.468 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -130.17 126.4 37.35 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.473 -0.767 . . . . 0.0 109.783 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.769 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.7 mt -104.64 117.91 35.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.251 -0.905 . . . . 0.0 110.376 -179.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.769 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.35 138.06 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.513 -0.742 . . . . 0.0 109.92 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.56 ' HB2' HD23 ' B' ' 67' ' ' LEU . 66.8 t80 -140.7 147.88 39.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.567 -0.708 . . . . 0.0 109.753 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 28.8 0.51 Allowed 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.416 -0.803 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.8 3.75 87.69 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.85 133.69 53.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.083 -1.245 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -78.49 134.3 37.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.064 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.881 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.9 mt -84.27 140.31 31.74 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.385 -0.822 . . . . 0.0 110.28 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -93.67 130.49 39.59 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.406 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.502 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.2 m-20 -48.43 -26.75 2.25 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.433 -0.792 . . . . 0.0 111.202 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.96 -8.05 86.33 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.702 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.479 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.34 159.04 15.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.01 -1.288 . . . . 0.0 110.432 -179.708 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.1 p -102.08 162.98 12.49 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.396 -0.815 . . . . 0.0 110.182 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.414 ' HA ' HD12 ' B' ' 61' ' ' ILE . 82.0 mt -53.45 -43.98 68.53 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.295 -0.878 . . . . 0.0 110.669 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.9 -34.72 68.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.413 -0.804 . . . . 0.0 111.131 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.5 -26.96 65.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.11 -0.994 . . . . 0.0 110.394 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.881 ' CD2' HD22 ' B' ' 50' ' ' LEU . 53.2 m-85 -101.15 26.21 7.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 110.053 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m120 50.63 31.06 5.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.541 -0.724 . . . . 0.0 110.728 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.5 mt -81.41 114.53 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.86 . . . . 0.0 109.784 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -105.55 167.86 9.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.384 -0.823 . . . . 0.0 110.219 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.9 pttt -46.54 153.13 0.39 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.479 -0.763 . . . . 0.0 111.041 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 21.0 mt-10 63.4 14.01 7.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.766 -0.584 . . . . 0.0 110.818 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.83 144.62 49.05 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.157 -0.964 . . . . 0.0 110.225 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.0 m -107.51 110.9 22.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.331 -0.856 . . . . 0.0 109.818 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.56 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.7 mt -102.38 165.03 11.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.252 -0.905 . . . . 0.0 110.344 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.412 ' NE2' HG12 ' A' ' 28' ' ' VAL . 60.2 m80 -108.82 129.53 55.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.358 -0.839 . . . . 0.0 110.125 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.423 HD22 HD13 ' B' ' 30' ' ' ILE . 60.3 tp -107.34 131.24 54.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.693 HG13 HD11 ' B' ' 8' ' ' LEU . 47.1 t -124.89 154.3 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.423 -0.798 . . . . 0.0 110.18 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 39.0 mt -94.44 110.21 22.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.375 -0.828 . . . . 0.0 110.219 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -84.82 87.84 7.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.864 . . . . 0.0 110.159 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 4.7 mt -97.12 129.93 44.46 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.18 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -162.12 83.24 0.57 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.411 -0.806 . . . . 0.0 110.155 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -113.33 67.47 0.25 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.97 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' HIS . . . . . 0.446 ' O ' ' N ' ' A' ' 3' ' ' LEU . 47.4 t-80 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.142 0.496 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.578 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 66.18 -64.67 0.21 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.571 -0.706 . . . . 0.0 110.657 179.995 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.578 ' CB ' ' O ' ' A' ' 2' ' ' MET . 0.9 OUTLIER 81.8 34.96 0.08 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.875 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.11 -30.98 58.21 Favored Glycine 0 N--CA 1.481 1.688 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -75.7 -39.35 57.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -1.1 . . . . 0.0 110.239 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . -77.02 -146.75 2.32 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.439 ' O ' ' N ' ' A' ' 9' ' ' ASP . . . 56.21 102.32 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.363 -1.08 . . . . 0.0 110.6 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m 67.0 -64.0 0.26 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.547 -0.721 . . . . 0.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 7' ' ' ALA . 1.1 m-20 -51.81 -27.64 13.05 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.294 -0.879 . . . . 0.0 110.442 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.401 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 28.6 m-85 -156.51 105.04 2.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.452 -0.78 . . . . 0.0 110.153 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -157.73 34.16 0.26 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.307 -0.871 . . . . 0.0 110.295 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -132.73 -53.04 0.93 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.349 -0.845 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -114.42 29.2 7.74 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.4 HG13 ' N ' ' A' ' 15' ' ' ASP . 11.3 p -125.51 -34.09 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -1.038 . . . . 0.0 110.402 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.4 ' N ' HG13 ' A' ' 14' ' ' VAL . 74.1 m-20 -129.48 126.74 22.92 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.304 -0.872 . . . . 0.0 110.15 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -70.69 -10.7 28.35 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.599 1.315 . . . . 0.0 110.859 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 52.7 p -69.87 -11.25 60.72 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.195 -0.941 . . . . 0.0 110.457 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.31 -26.62 26.45 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.227 -0.92 . . . . 0.0 110.276 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -168.31 117.09 0.63 Allowed Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.39 -14.59 34.23 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 124.013 1.533 . . . . 0.0 110.094 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.403 ' HB3' ' CG1' ' B' ' 70' ' ' VAL . 0.1 OUTLIER -74.39 -31.67 62.44 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.455 -0.778 . . . . 0.0 109.358 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.11 -30.87 25.61 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.62 -35.57 77.49 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.152 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.673 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -77.78 -34.58 52.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.73 . . . . 0.0 109.492 179.34 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.24 -31.02 72.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.472 -0.767 . . . . 0.0 109.969 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.6 -25.56 33.09 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.377 -0.827 . . . . 0.0 110.125 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -83.78 -28.98 27.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.605 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.673 HG23 ' O ' ' A' ' 24' ' ' LEU . 64.3 t -80.84 -28.36 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.919 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -78.43 -45.2 22.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.475 -0.766 . . . . 0.0 110.128 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.6 tpt -64.81 -39.19 93.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.401 -0.812 . . . . 0.0 110.043 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -68.83 -32.23 71.77 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.452 -0.78 . . . . 0.0 110.228 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.25 -48.24 62.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.346 -0.846 . . . . 0.0 110.115 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -29.71 66.89 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.348 -0.845 . . . . 0.0 110.164 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -44.65 63.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -29.13 66.2 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.332 -0.855 . . . . 0.0 110.356 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -81.02 -47.25 13.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.324 -0.86 . . . . 0.0 110.134 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.8 OUTLIER -75.1 -19.91 59.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.324 -0.86 . . . . 0.0 110.194 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -83.76 -58.89 2.61 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.691 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -52.29 -33.81 43.87 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.428 -0.795 . . . . 0.0 109.294 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -81.35 -35.17 31.22 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.85 -52.76 58.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.537 -0.727 . . . . 0.0 109.562 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 14.6 ptt85 -68.59 -30.63 69.42 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.389 -0.819 . . . . 0.0 109.65 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.2 mmm180 -53.13 -40.63 64.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.431 -0.793 . . . . 0.0 109.396 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.58 -27.75 37.35 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.547 -0.721 . . . . 0.0 109.093 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -65.82 -29.93 70.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.557 -0.715 . . . . 0.0 109.799 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.26 -50.04 6.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.5 67.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.38 -0.825 . . . . 0.0 110.07 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.3 p -88.17 -45.76 9.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.393 -0.817 . . . . 0.0 110.146 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.84 -30.31 71.4 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.444 -0.785 . . . . 0.0 110.233 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.59 -32.58 72.69 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.38 -0.825 . . . . 0.0 110.104 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -114.44 47.12 1.27 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.403 -0.81 . . . . 0.0 110.189 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -168.23 -53.71 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.307 -0.871 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.65 -32.43 57.38 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 54' ' ' ILE . 6.1 tp -123.04 83.57 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -1.11 . . . . 0.0 110.248 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -116.6 90.25 3.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.243 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.569 HG23 ' O ' ' A' ' 56' ' ' THR . 8.5 t -64.78 119.11 10.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.389 -0.819 . . . . 0.0 110.233 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 57' ' ' THR . 28.7 m -109.2 50.14 0.79 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.351 -0.843 . . . . 0.0 110.274 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -149.1 -128.83 1.72 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.517 HG23 ' O ' ' A' ' 59' ' ' THR . 6.0 t -161.36 70.02 0.35 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -1.061 . . . . 0.0 110.176 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.13 61.96 1.35 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.356 -0.84 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 -54.92 0.2 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.171 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.591 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -109.79 75.2 0.93 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.431 -0.793 . . . . 0.0 110.116 -180.0 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.47 -47.99 24.65 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.27 -0.894 . . . . 0.0 110.364 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.18 -28.89 61.51 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.243 -0.91 . . . . 0.0 109.075 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.591 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -61.68 -44.47 96.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.939 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.4 tp -65.08 -28.35 69.4 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.568 ' C ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -73.45 -48.35 34.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.535 -0.728 . . . . 0.0 109.563 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.63 -52.95 7.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 110.545 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 tpt -51.73 -38.78 56.77 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.232 -0.917 . . . . 0.0 110.824 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.3 m -71.11 -40.65 71.33 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.264 -0.898 . . . . 0.0 110.396 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 tp -83.65 -13.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.973 . . . . 0.0 110.226 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -76.28 -48.43 20.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.293 -0.88 . . . . 0.0 109.784 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -25.41 47.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 110.064 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -81.72 -47.69 12.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.831 . . . . 0.0 110.223 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.29 -44.19 97.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.286 -0.883 . . . . 0.0 110.155 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -83.67 90.32 7.27 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.458 -0.776 . . . . 0.0 110.153 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.53 -41.4 0.04 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.539 -1.425 . . . . 0.0 109.539 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.93 88.56 7.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.384 -1.068 . . . . 0.0 110.198 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -153.12 90.34 1.43 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.423 -0.798 . . . . 0.0 110.136 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.411 ' H ' HD23 ' A' ' 81' ' ' LEU . . . -135.64 47.92 0.95 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.411 HD23 ' H ' ' A' ' 80' ' ' GLY . 0.5 OUTLIER -173.18 149.16 1.69 Allowed Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.37 -1.076 . . . . 0.0 108.911 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -72.12 63.38 3.39 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 123.51 1.269 . . . . 0.0 110.535 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 p-10 -71.1 70.21 0.53 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.183 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.13 -29.33 61.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.117 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -64.56 -19.54 65.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.358 -0.839 . . . . 0.0 110.419 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.4 t -102.49 -19.05 15.05 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.606 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.411 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 9.6 mtp -88.98 129.79 35.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.191 -0.943 . . . . 0.0 110.301 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 75.4 p -79.48 -163.75 0.55 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.449 -0.782 . . . . 0.0 110.496 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.545 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -67.24 -31.83 72.44 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.477 -0.764 . . . . 0.0 109.248 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 27.3 mt-10 -85.44 -40.61 16.22 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -63.89 -42.26 97.52 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HG3' ' HB3' ' A' ' 87' ' ' MET . 94.0 mt-30 -69.1 -35.39 76.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.021 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.545 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.31 -36.83 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.87 -29.76 69.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 109.616 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -83.82 -38.51 21.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.466 -0.772 . . . . 0.0 110.057 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -79.57 -28.98 41.12 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.329 -0.857 . . . . 0.0 110.469 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.462 ' O ' HD23 ' A' ' 101' ' ' LEU . 1.7 tmt? -83.96 -31.83 25.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.3 -0.875 . . . . 0.0 109.73 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -73.03 -29.37 62.94 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.505 -0.747 . . . . 0.0 110.008 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.36 -21.26 22.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.426 -0.796 . . . . 0.0 110.269 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.43 -57.53 3.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.213 -0.929 . . . . 0.0 110.373 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.582 HD12 ' N ' ' A' ' 102' ' ' GLN . 4.3 pp -61.74 -28.16 69.23 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.278 -0.889 . . . . 0.0 110.272 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLN . . . . . 0.582 ' N ' HD12 ' A' ' 101' ' ' LEU . 51.2 tt0 -61.69 -55.37 31.13 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.404 -0.81 . . . . 0.0 110.171 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.78 132.96 4.46 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -150.89 70.51 1.0 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.374 -1.074 . . . . 0.0 110.157 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -116.43 -57.06 2.24 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.342 -0.849 . . . . 0.0 110.128 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -115.61 69.49 0.73 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.428 -0.795 . . . . 0.0 110.16 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -83.8 124.28 6.55 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.73 57.9 1.38 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.333 -1.098 . . . . 0.0 110.258 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.97 -66.09 0.95 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.36 -0.838 . . . . 0.0 110.186 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 51.9 56.86 7.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.405 -0.81 . . . . 0.0 110.433 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -138.77 64.81 1.47 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.169 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.262 179.971 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.4 ttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.303 0.573 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -112.96 140.19 47.97 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.374 -0.829 . . . . 0.0 109.606 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.504 HD13 HG21 ' B' ' 17' ' ' VAL . 43.2 pt -137.72 157.15 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.212 -0.93 . . . . 0.0 110.535 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -111.89 144.89 40.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.598 -0.689 . . . . 0.0 110.546 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 68.4 t -128.13 122.38 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.342 -0.849 . . . . 0.0 109.603 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.469 ' HG3' HG23 ' B' ' 12' ' ' THR . 12.0 mttt -100.16 131.98 45.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.689 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.4 p -95.79 175.71 6.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.431 -0.793 . . . . 0.0 109.921 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 22.1 mt -61.57 -12.77 16.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.309 -0.869 . . . . 0.0 111.17 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.2 p -95.73 14.5 22.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.007 -1.058 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.84 8.34 68.1 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.432 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 24.5 tttt -84.79 134.02 34.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.066 -1.256 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.469 HG23 ' HG3' ' B' ' 6' ' ' LYS . 5.3 m -113.26 130.28 56.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -0.881 . . . . 0.0 110.318 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 mt -109.15 141.89 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.401 -0.812 . . . . 0.0 110.239 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 8.5 m -101.84 121.94 43.05 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.441 -0.787 . . . . 0.0 109.504 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.443 HD23 ' HE2' ' B' ' 33' ' ' LYS . 4.6 mt -123.27 156.27 35.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.16 -0.963 . . . . 0.0 110.831 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 113.95 27.79 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.422 -0.798 . . . . 0.0 109.422 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.691 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.2 m -139.9 178.46 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.309 -0.869 . . . . 0.0 110.856 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.609 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -113.01 166.14 11.7 Favored Pre-proline 0 N--CA 1.489 1.492 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.662 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.27 -28.86 14.81 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.469 1.247 . . . . 0.0 110.277 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.44 -0.68 53.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.63 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -71.21 142.71 50.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.38 159.51 21.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.537 -0.727 . . . . 0.0 110.498 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.861 HG23 HD12 ' B' ' 43' ' ' LEU . 44.1 mm -59.71 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.363 -0.836 . . . . 0.0 109.565 179.43 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -36.88 74.74 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.385 -0.822 . . . . 0.0 109.425 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -70.06 -31.17 68.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.495 -0.753 . . . . 0.0 109.208 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 22' ' ' THR . 58.2 t -70.24 -39.89 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 119.839 -0.745 . . . . 0.0 109.134 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -63.26 -43.05 99.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.502 -0.749 . . . . 0.0 109.178 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.9 76.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.502 -0.749 . . . . 0.0 109.49 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.691 ' CD ' HG12 ' B' ' 17' ' ' VAL . 30.4 mttm -68.12 -38.32 82.09 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.501 -0.749 . . . . 0.0 109.491 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.19 -39.73 83.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.415 -0.803 . . . . 0.0 109.111 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' B' ' 35' ' ' GLY . 13.9 tt0 -60.61 -47.86 84.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.301 -0.875 . . . . 0.0 109.299 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -58.01 -27.76 63.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.407 -0.808 . . . . 0.0 110.241 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.443 ' HE2' HD23 ' B' ' 15' ' ' LEU . 2.9 mmtm -84.27 -41.26 17.06 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.399 -0.813 . . . . 0.0 110.874 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -107.76 -55.79 2.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.248 -0.907 . . . . 0.0 110.365 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.8 21.27 1.77 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.524 HG23 ' HD2' ' B' ' 37' ' ' PRO . 56.8 mt -91.65 144.4 29.44 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.197 -1.178 . . . . 0.0 109.976 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.524 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -68.51 131.83 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.536 1.282 . . . . 0.0 110.622 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.96 -24.61 79.87 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.653 1.344 . . . . 0.0 110.714 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.61 -25.4 64.84 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.829 . . . . 0.0 109.731 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.429 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 0.2 OUTLIER -101.33 0.1 36.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.49 -0.756 . . . . 0.0 110.425 179.765 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -94.44 137.22 33.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.201 -0.937 . . . . 0.0 110.475 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.22 134.69 47.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.454 -0.779 . . . . 0.0 109.765 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.861 HD12 HG23 ' B' ' 23' ' ' ILE . 18.0 mt -104.67 116.59 32.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.217 -0.927 . . . . 0.0 110.333 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.788 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.2 mp -121.21 135.14 62.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.463 -0.773 . . . . 0.0 109.831 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.526 ' HB2' HD23 ' B' ' 67' ' ' LEU . 25.8 t80 -140.69 145.98 37.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.338 -0.851 . . . . 0.0 109.767 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.66 28.93 0.59 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.741 . . . . 0.0 110.932 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.56 5.1 88.02 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -111.03 128.71 55.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.166 -1.197 . . . . 0.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 132.48 37.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 109.589 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.845 HD22 ' CD2' ' B' ' 59' ' ' TYR . 48.9 mt -83.74 142.96 30.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.223 -0.923 . . . . 0.0 110.274 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -93.5 133.12 37.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.486 -0.759 . . . . 0.0 110.442 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.478 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 65.9 m-20 -48.54 -28.18 3.22 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.565 -0.709 . . . . 0.0 111.027 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -5.85 88.81 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 120.116 -1.04 . . . . 0.0 110.692 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.455 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 11.2 mmt180 -99.51 153.57 18.92 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.027 -1.278 . . . . 0.0 110.488 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.6 p -102.23 165.63 11.03 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.291 -0.881 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.609 HD12 ' O ' ' B' ' 18' ' ' GLU . 87.8 mt -53.6 -45.66 70.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.29 -0.881 . . . . 0.0 110.78 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -56.82 -38.39 72.54 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.432 -0.792 . . . . 0.0 110.958 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -59.68 -27.93 66.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.325 -0.86 . . . . 0.0 110.425 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.845 ' CD2' HD22 ' B' ' 50' ' ' LEU . 40.8 m-85 -100.98 26.72 6.67 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.954 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 50.69 27.39 2.97 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.569 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.565 HG21 HD22 ' B' ' 56' ' ' LEU . 88.0 mt -81.37 109.46 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.377 -0.827 . . . . 0.0 109.79 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.54 172.11 6.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.426 -0.796 . . . . 0.0 110.164 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.44 152.73 0.42 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.547 -0.721 . . . . 0.0 111.084 -179.841 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.7 mm-40 63.0 16.55 9.37 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.81 -0.556 . . . . 0.0 110.595 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.63 145.66 48.82 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.3 m -107.91 108.05 19.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.526 HD23 ' HB2' ' B' ' 45' ' ' PHE . 10.3 mt -102.54 157.96 16.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.29 -0.881 . . . . 0.0 110.091 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -108.88 138.52 45.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.254 -0.904 . . . . 0.0 109.995 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 45.9 tp -106.95 133.16 52.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.349 -0.845 . . . . 0.0 110.276 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.403 ' CG1' ' HB3' ' A' ' 21' ' ' GLU . 61.5 t -125.01 158.14 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 110.405 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 12.5 mt -94.26 121.44 35.78 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.312 -0.867 . . . . 0.0 110.251 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.23 101.76 13.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.351 -0.843 . . . . 0.0 110.164 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 mp -104.86 178.19 4.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.342 -0.849 . . . . 0.0 110.325 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.62 95.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.391 -0.818 . . . . 0.0 110.558 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -92.54 163.93 27.68 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.037 -1.424 . . . . 0.0 109.578 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.2 t60 . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.15 0.5 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtp -62.08 -177.17 0.11 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.825 . . . . 0.0 110.195 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.71 24.48 12.41 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.438 -0.789 . . . . 0.0 109.689 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.55 -102.19 0.09 OUTLIER Glycine 0 N--CA 1.488 2.165 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mt -128.26 -62.94 1.02 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.383 -1.069 . . . . 0.0 110.139 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.37 -164.87 19.48 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.6 32.97 5.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.332 -1.099 . . . . 0.0 110.17 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -146.75 21.69 1.28 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.422 -0.799 . . . . 0.0 110.326 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.96 -18.0 15.87 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.316 -0.865 . . . . 0.0 110.177 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 27.0 p90 -161.99 45.67 0.16 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.341 -0.849 . . . . 0.0 110.133 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.03 68.93 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.536 -0.727 . . . . 0.0 110.107 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 52.32 25.07 3.19 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.285 -0.884 . . . . 0.0 110.519 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -117.8 35.4 4.09 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.1 t -143.57 -64.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -1.071 . . . . 0.0 110.166 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.54 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.4 OUTLIER -166.36 -178.75 0.73 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.483 -0.761 . . . . 0.0 109.577 -179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.685 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 37.2 Cg_endo -61.33 78.27 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.486 1.256 . . . . 0.0 111.028 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.455 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 69.6 44.63 0.87 Allowed 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.7 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.49 25.25 0.07 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.27 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.605 ' HB3' HD12 ' A' ' 22' ' ' LEU . 0.7 OUTLIER -170.15 112.78 0.47 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.133 -0.979 . . . . 0.0 110.342 179.936 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.23 -14.37 28.52 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.932 1.49 . . . . 0.0 109.828 179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.46 ' HB3' HG13 ' B' ' 70' ' ' VAL . 46.7 mt-10 -75.75 -35.94 60.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.439 -0.788 . . . . 0.0 109.444 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 19' ' ' ASP . 3.6 mt -78.09 -30.23 49.47 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.082 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.685 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -70.14 -36.63 74.91 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 0.0 109.175 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.689 ' O ' HG23 ' A' ' 28' ' ' VAL . 29.7 tp -77.31 -30.41 54.1 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.631 -0.668 . . . . 0.0 109.362 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -38.44 91.15 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.321 -0.862 . . . . 0.0 109.729 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 68.2 tp -80.39 -22.13 41.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.466 -0.771 . . . . 0.0 110.194 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.02 -28.94 35.24 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.3 -0.875 . . . . 0.0 109.207 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 24' ' ' LEU . 94.2 t -79.69 -28.72 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 121.631 -0.668 . . . . 0.0 109.589 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.8 p -74.28 -43.37 57.17 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.536 -0.727 . . . . 0.0 110.01 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.9 mmt -68.6 -31.22 70.24 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.423 -0.798 . . . . 0.0 110.207 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.6 -33.45 64.61 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.344 -0.847 . . . . 0.0 110.104 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -69.9 -45.48 67.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.835 . . . . 0.0 110.126 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -65.65 -36.13 82.79 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.4 -0.812 . . . . 0.0 110.268 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.48 -43.01 81.99 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.382 -0.824 . . . . 0.0 110.098 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -58.98 -41.86 88.6 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.285 -0.885 . . . . 0.0 110.323 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -78.35 -39.84 38.23 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.373 -0.829 . . . . 0.0 110.279 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.58 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 32.4 mt-30 -73.68 -24.18 59.93 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -77.24 -55.04 5.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 109.477 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -53.26 -32.17 47.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.344 -0.847 . . . . 0.0 109.073 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -87.11 -34.52 19.08 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.695 -0.628 . . . . 0.0 109.499 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.58 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -67.22 -50.95 58.86 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.361 -0.837 . . . . 0.0 110.017 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -66.8 -36.06 81.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 110.395 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -57.1 -37.81 72.47 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.342 -0.849 . . . . 0.0 110.133 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.84 -26.13 37.24 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.436 -0.79 . . . . 0.0 109.916 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.29 59.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.398 -0.814 . . . . 0.0 109.989 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.32 -38.26 20.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.219 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.33 -33.07 74.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.345 -0.847 . . . . 0.0 110.158 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -80.04 -31.23 39.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.385 -0.822 . . . . 0.0 110.182 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.85 95.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.351 -0.843 . . . . 0.0 110.168 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.733 ' O ' HG22 ' A' ' 54' ' ' ILE . . . -76.24 -21.16 56.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.321 -0.862 . . . . 0.0 110.352 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -55.38 -24.37 29.47 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.285 -0.884 . . . . 0.0 110.522 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -109.74 -25.59 10.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.205 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.16 67.1 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.733 HG22 ' O ' ' A' ' 50' ' ' ALA . 13.8 tt -108.25 77.13 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.295 -1.12 . . . . 0.0 110.257 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -164.67 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.229 -0.919 . . . . 0.0 110.239 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.3 p -139.89 52.35 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.375 -0.828 . . . . 0.0 110.263 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 p -124.91 -60.21 1.38 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.382 -0.824 . . . . 0.0 110.288 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -148.6 39.21 0.97 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.3 p -80.76 76.44 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.269 -1.136 . . . . 0.0 110.269 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -91.53 55.79 2.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.257 -0.902 . . . . 0.0 110.174 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.98 -32.31 61.65 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.319 -0.863 . . . . 0.0 110.225 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.7 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.5 OUTLIER -100.89 73.27 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.43 -0.794 . . . . 0.0 110.088 -179.922 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.49 -38.02 74.29 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -75.1 -28.92 60.45 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.246 -0.909 . . . . 0.0 109.145 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.7 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -62.42 -43.92 97.66 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.685 -0.806 . . . . 0.0 108.869 179.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -28.62 69.44 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -75.69 -45.78 34.95 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.598 -0.688 . . . . 0.0 109.869 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.447 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.01 -53.51 6.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.484 -0.76 . . . . 0.0 110.487 -179.851 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.92 -40.37 60.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.139 -0.976 . . . . 0.0 110.643 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.2 m -69.43 -41.17 76.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.259 -0.9 . . . . 0.0 110.423 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.447 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.0 tp -85.38 -10.62 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.076 -1.015 . . . . 0.0 110.466 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 30.3 t -80.32 -36.27 34.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.717 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -89.25 -23.87 22.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.54 -0.725 . . . . 0.0 110.067 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -89.84 -40.71 12.26 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.344 -0.847 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.12 -33.41 26.31 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.303 -0.873 . . . . 0.0 110.181 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -118.97 45.7 2.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.303 -0.873 . . . . 0.0 110.245 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -119.18 -51.33 0.29 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 106.36 18.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.356 -1.084 . . . . 0.0 110.124 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.2 m -153.02 30.64 0.49 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.45 -0.781 . . . . 0.0 110.285 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.48 ' O ' HD12 ' A' ' 81' ' ' LEU . . . -96.93 36.19 4.03 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.516 -1.433 . . . . 0.0 109.516 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.48 HD12 ' O ' ' A' ' 80' ' ' GLY . 0.3 OUTLIER -161.47 142.58 8.46 Favored Pre-proline 0 C--N 1.307 -1.265 0 O-C-N 121.393 -1.063 . . . . 0.0 108.911 179.827 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.537 ' O ' HD12 ' A' ' 84' ' ' LEU . 47.3 Cg_endo -74.72 50.52 2.44 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 123.52 1.274 . . . . 0.0 110.441 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.65 98.82 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.921 . . . . 0.0 110.198 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.537 HD12 ' O ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -101.4 -24.79 14.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.316 -0.865 . . . . 0.0 110.262 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.38 -28.04 57.98 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.394 -0.816 . . . . 0.0 110.292 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.99 -21.38 18.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.351 -0.843 . . . . 0.0 110.285 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.1 mtt -71.37 122.06 19.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.263 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.492 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.7 p -73.1 -162.32 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.47 -0.769 . . . . 0.0 110.367 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.543 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.9 pt-20 -69.49 -29.45 67.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.511 -0.743 . . . . 0.0 109.365 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.437 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.7 OUTLIER -84.7 -38.41 19.77 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.492 ' HB2' ' N ' ' A' ' 88' ' ' THR . 10.0 mm-40 -66.52 -43.77 84.29 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -66.6 -35.39 80.09 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.543 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.8 -35.74 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.703 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.2 -38.84 92.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.622 -0.674 . . . . 0.0 109.402 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -44.89 59.23 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.508 -0.745 . . . . 0.0 109.95 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.77 82.16 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.414 -0.804 . . . . 0.0 110.019 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 20.5 mmt -79.32 -24.64 42.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.31 -0.869 . . . . 0.0 109.628 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -65.88 -44.39 85.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 0.0 109.991 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 41.4 mtp -76.18 -26.13 55.91 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.364 -0.835 . . . . 0.0 110.08 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 39.5 t -73.52 -29.04 62.22 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.406 -0.809 . . . . 0.0 110.086 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mp -87.86 7.34 31.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.32 -0.862 . . . . 0.0 110.466 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -68.15 -35.03 77.41 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.203 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.9 23.58 55.18 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -169.7 64.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.25 -1.147 . . . . 0.0 110.174 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -86.53 -38.42 17.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.843 . . . . 0.0 110.144 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -88.23 -20.69 25.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.37 -0.831 . . . . 0.0 110.352 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.08 92.52 0.05 OUTLIER Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.66 66.84 1.25 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.405 -1.056 . . . . 0.0 110.05 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -164.83 115.49 1.16 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.283 -0.886 . . . . 0.0 110.216 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -128.02 91.83 3.34 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.326 -0.859 . . . . 0.0 110.259 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 56.8 p -130.76 -174.85 3.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.276 -0.89 . . . . 0.0 110.236 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.169 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.461 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.4 ttp . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.241 0.543 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -88.09 140.78 29.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.0 109.717 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.492 HD13 HG21 ' B' ' 17' ' ' VAL . 35.3 pt -137.37 157.65 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.257 -0.902 . . . . 0.0 110.259 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.8 144.31 41.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.654 -0.654 . . . . 0.0 110.598 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 12' ' ' THR . 61.3 t -128.16 126.02 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 109.659 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.43 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -99.81 138.45 36.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.285 -0.885 . . . . 0.0 110.636 -179.501 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 74.2 p -95.85 171.56 8.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.479 -0.763 . . . . 0.0 110.481 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.34 -14.05 24.16 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -0.813 . . . . 0.0 111.164 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.2 p -95.6 -23.6 16.97 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.092 -1.005 . . . . 0.0 110.75 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.59 10.94 8.98 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.3 ttpm? -84.57 137.42 33.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.268 . . . . 0.0 109.797 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 10.0 m -113.12 126.31 55.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.291 -0.881 . . . . 0.0 110.306 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 mt -108.96 136.3 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.411 -0.806 . . . . 0.0 110.255 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.4 m -101.85 121.09 41.45 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 109.319 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mt -123.3 159.37 28.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.192 -0.943 . . . . 0.0 110.858 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -106.35 113.71 27.39 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.183 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.655 HG12 ' HD2' ' B' ' 29' ' ' LYS . 33.8 m -140.19 174.34 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.331 -0.856 . . . . 0.0 110.951 -178.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.618 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.4 OUTLIER -112.9 165.41 13.19 Favored Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.637 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.92 -26.97 18.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.525 1.276 . . . . 0.0 110.326 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.39 -2.63 57.46 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 110.522 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.58 142.28 50.03 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 65.8 p -83.41 160.5 21.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.704 . . . . 0.0 110.485 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.674 HG23 HD12 ' B' ' 43' ' ' LEU . 42.0 mm -59.64 -35.64 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.619 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.86 -35.88 75.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.197 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -32.21 69.53 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.536 -0.728 . . . . 0.0 109.29 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 72.4 t -69.96 -42.84 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.499 -0.751 . . . . 0.0 109.387 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -62.88 -40.69 98.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.466 -0.771 . . . . 0.0 109.324 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -36.46 81.03 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.682 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.655 ' HD2' HG12 ' B' ' 17' ' ' VAL . 40.4 mttp -68.15 -38.12 81.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 0.0 109.688 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mt -67.02 -39.59 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.374 -0.829 . . . . 0.0 109.119 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.2 tm0? -60.48 -48.89 79.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.429 -0.794 . . . . 0.0 109.422 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.08 -26.55 62.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.787 . . . . 0.0 110.25 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -84.07 -39.97 18.9 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -108.03 -55.97 2.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.316 -0.865 . . . . 0.0 110.622 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.02 15.7 2.29 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.519 HG23 ' HD2' ' B' ' 37' ' ' PRO . 60.7 mt -91.38 144.62 29.99 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.134 -1.215 . . . . 0.0 109.849 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.519 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -69.77 134.64 28.45 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.546 1.287 . . . . 0.0 110.454 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -61.02 -26.59 83.34 Favored 'Trans proline' 0 C--N 1.312 -1.376 0 O-C-N 123.793 1.417 . . . . 0.0 111.152 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.92 -19.67 64.2 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.26 -0.9 . . . . 0.0 110.228 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.465 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.4 mp0 -100.98 -9.42 21.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 110.753 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' GLN . . . . . 0.416 ' HB3' HD11 ' B' ' 69' ' ' LEU . 19.2 mt-30 -94.35 145.7 24.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.166 -0.959 . . . . 0.0 110.873 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.463 ' HG2' HD11 ' B' ' 44' ' ' ILE . 3.6 ttt85 -130.18 134.25 47.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.514 -0.742 . . . . 0.0 109.522 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.786 ' C ' HD12 ' B' ' 44' ' ' ILE . 25.8 mt -104.34 117.54 34.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.423 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.786 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.1 mp -121.2 133.68 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.633 -0.667 . . . . 0.0 109.742 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.419 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 28.4 t80 -140.63 151.44 44.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.454 -0.779 . . . . 0.0 109.902 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.419 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.42 27.41 0.37 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.491 -0.756 . . . . 0.0 111.243 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.81 -0.82 81.16 Favored Glycine 0 N--CA 1.495 2.594 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.605 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.87 136.0 50.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.069 -1.254 . . . . 0.0 110.275 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.5 137.06 37.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.88 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.711 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.5 mt -84.1 139.9 32.16 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.0 110.324 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -93.61 134.71 35.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.306 -0.871 . . . . 0.0 110.465 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.454 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.7 p-10 -48.6 -30.89 5.84 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.495 -0.753 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.01 -4.02 90.18 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 23.6 mmt180 -99.63 153.54 18.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.053 -1.263 . . . . 0.0 110.652 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 78.4 p -102.33 163.42 12.24 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.333 -0.854 . . . . 0.0 110.222 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.618 HD12 ' O ' ' B' ' 18' ' ' GLU . 71.9 mt -53.52 -43.87 68.68 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.223 -0.923 . . . . 0.0 110.616 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 85.8 p -56.67 -37.33 70.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.389 -0.819 . . . . 0.0 111.051 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.44 -26.46 65.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.185 -0.947 . . . . 0.0 110.354 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.711 ' CD2' HD22 ' B' ' 50' ' ' LEU . 70.0 m-85 -101.24 25.11 8.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.177 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t30 50.52 29.21 3.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.477 -0.764 . . . . 0.0 110.726 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.662 HD13 HD21 ' B' ' 67' ' ' LEU . 94.1 mt -81.39 112.45 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 109.759 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -105.57 170.77 7.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.373 -0.829 . . . . 0.0 110.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.0 OUTLIER -46.53 151.89 0.51 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.56 -0.713 . . . . 0.0 111.04 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 52.2 mm-40 62.86 16.44 9.11 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.714 -0.616 . . . . 0.0 110.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 147.7 47.22 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.907 . . . . 0.0 110.205 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -107.66 109.22 20.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.374 -0.828 . . . . 0.0 109.878 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.662 HD21 HD13 ' B' ' 61' ' ' ILE . 1.3 mt -102.23 158.85 15.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.322 -0.862 . . . . 0.0 110.019 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -108.77 131.98 54.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.86 . . . . 0.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.416 HD11 ' HB3' ' B' ' 41' ' ' GLN . 31.0 tp -107.19 136.08 47.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.35 -0.844 . . . . 0.0 110.009 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.46 HG13 ' HB3' ' A' ' 21' ' ' GLU . 19.0 t -124.7 149.63 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.271 -0.893 . . . . 0.0 110.222 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mt -94.6 122.46 37.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.413 -0.804 . . . . 0.0 110.143 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -86.28 66.64 9.63 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.32 -0.863 . . . . 0.0 110.109 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -62.4 172.1 1.66 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.368 -0.833 . . . . 0.0 110.268 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.64 126.41 30.95 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.456 -0.778 . . . . 0.0 110.124 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.75 34.28 1.89 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 CA-C-O 117.986 -1.452 . . . . 0.0 109.556 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.7 t0 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.31 0.576 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.18 -27.11 60.66 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.22 -0.925 . . . . 0.0 109.084 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.39 -42.17 99.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.629 -0.829 . . . . 0.0 108.807 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.54 -30.38 70.67 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.44 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -77.1 -35.22 56.56 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.569 -0.707 . . . . 0.0 109.774 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.79 -55.91 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.337 -179.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -44.29 67.19 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 110.536 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.2 m -67.06 -44.69 79.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.409 -0.807 . . . . 0.0 110.618 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.8 tp -80.52 -12.08 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.275 -0.891 . . . . 0.0 110.259 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.6 m -76.05 -41.52 50.45 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -82.26 -24.56 34.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.452 -0.78 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.309 -0.869 . . . . 0.0 110.366 -179.98 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.9 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.368 0.604 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.563 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.3 pt-20 -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.538 -0.726 . . . . 0.0 109.268 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.443 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.6 mt-10 -85.43 -40.07 16.84 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.01 -42.73 97.05 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -69.57 -34.9 74.83 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.67 -37.15 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.879 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.79 -34.87 79.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -77.82 -44.59 26.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.565 -0.709 . . . . 0.0 109.926 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.86 -33.38 72.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.369 -0.832 . . . . 0.0 110.065 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.9 tpp -80.58 -21.91 41.21 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.801 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.459 -0.775 . . . . 0.0 110.028 179.847 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.443 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.9 ttp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.131 0.491 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -89.98 139.87 30.19 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.335 -0.853 . . . . 0.0 109.779 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 21.9 pt -137.56 159.64 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.915 . . . . 0.0 110.353 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.92 143.54 42.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.713 -0.617 . . . . 0.0 110.517 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 65.0 t -128.02 121.07 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.321 -0.862 . . . . 0.0 109.854 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 4.0 mtpt -99.98 128.13 46.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.181 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.7 p -95.9 177.27 5.82 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.485 -0.759 . . . . 0.0 110.506 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.489 HD21 HG22 ' B' ' 70' ' ' VAL . 4.6 mm? -61.35 -14.46 27.46 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.557 -0.714 . . . . 0.0 110.956 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.7 p -95.61 17.74 14.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.154 -0.966 . . . . 0.0 110.683 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.12 11.06 58.11 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 6.2 tmtm? -85.0 132.63 34.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.08 -1.247 . . . . 0.0 109.816 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -113.19 125.19 54.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.396 -0.815 . . . . 0.0 110.273 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.7 mt -109.31 135.4 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 110.405 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.3 m -102.32 118.48 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.194 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -123.5 164.22 19.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.229 -0.92 . . . . 0.0 110.916 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -106.38 116.99 32.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.495 -0.753 . . . . 0.0 109.423 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.459 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.7 m -140.17 174.98 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.841 . . . . 0.0 110.746 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -113.1 165.81 12.43 Favored Pre-proline 0 N--CA 1.488 1.444 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.69 -26.13 16.53 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 123.617 1.325 . . . . 0.0 110.398 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.51 -4.0 58.71 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.057 -1.027 . . . . 0.0 110.508 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.22 138.84 49.82 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.54 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 68.0 p -83.37 160.24 21.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.482 -0.761 . . . . 0.0 110.248 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.705 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.22 -28.98 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.93 -40.51 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 109.38 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -70.14 -31.36 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.544 -0.722 . . . . 0.0 109.483 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 81.8 t -70.16 -40.97 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.773 . . . . 0.0 109.27 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -62.99 -42.98 99.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.406 -0.809 . . . . 0.0 109.238 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -34.29 75.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.47 -0.769 . . . . 0.0 109.475 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.459 ' CD ' HG12 ' B' ' 17' ' ' VAL . 21.9 mttp -68.03 -39.97 83.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.524 -0.735 . . . . 0.0 109.674 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.506 HD13 HD22 ' B' ' 69' ' ' LEU . 18.7 mt -67.15 -37.68 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 0.0 109.071 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -52.08 66.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.813 . . . . 0.0 109.68 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -58.13 -27.63 63.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.451 -0.781 . . . . 0.0 110.643 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.03 -38.2 21.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.164 -0.96 . . . . 0.0 110.854 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -108.07 -56.43 2.24 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.226 -0.921 . . . . 0.0 110.502 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.15 17.64 1.98 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.499 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.9 mt -91.44 143.59 28.39 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.076 -1.249 . . . . 0.0 109.785 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -67.66 133.44 29.72 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.65 1.342 . . . . 0.0 110.415 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.69 -26.7 83.47 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.732 1.386 . . . . 0.0 110.849 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -24.89 64.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.84 . . . . 0.0 109.956 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.418 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.1 mt-30 -101.31 3.11 40.4 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.348 -0.845 . . . . 0.0 110.465 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -94.17 137.65 33.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.124 -0.985 . . . . 0.0 110.327 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -130.06 129.52 43.73 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.429 -0.794 . . . . 0.0 109.863 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.793 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.9 mt -104.45 116.89 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.397 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.793 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.37 135.36 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.482 -0.761 . . . . 0.0 109.675 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.483 ' HB2' HD23 ' B' ' 67' ' ' LEU . 44.0 t80 -141.12 154.06 45.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 26.73 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.481 -0.762 . . . . 0.0 111.329 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.99 -3.74 74.54 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.159 -1.02 . . . . 0.0 110.621 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 136.93 49.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.976 -1.308 . . . . 0.0 110.31 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.29 134.92 37.45 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.21 -0.931 . . . . 0.0 109.832 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.665 HD22 ' CG ' ' B' ' 59' ' ' TYR . 26.7 mt -83.96 144.77 28.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . 0.403 ' HB2' ' CG ' ' B' ' 54' ' ' ARG . 56.0 mm-40 -93.65 130.59 39.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.378 -0.826 . . . . 0.0 110.433 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.426 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.4 p30 -48.58 -26.83 2.41 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.522 -0.736 . . . . 0.0 111.435 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.64 -5.16 89.72 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.403 ' CG ' ' HB2' ' B' ' 51' ' ' GLU . 13.5 mmt180 -99.6 157.91 16.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.076 -1.249 . . . . 0.0 110.45 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 65.2 p -102.63 161.5 13.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.82 . . . . 0.0 110.212 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.546 HD22 HG21 ' B' ' 61' ' ' ILE . 68.7 mt -53.63 -47.34 70.36 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.389 -0.819 . . . . 0.0 110.626 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.8 t -56.74 -37.0 70.4 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.432 -0.793 . . . . 0.0 111.17 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.33 -26.62 65.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.147 -0.971 . . . . 0.0 110.24 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.665 ' CG ' HD22 ' B' ' 50' ' ' LEU . 25.3 m-85 -101.04 27.16 6.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.379 -0.826 . . . . 0.0 109.829 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.64 28.01 3.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.444 -0.785 . . . . 0.0 110.688 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.546 HG21 HD22 ' B' ' 56' ' ' LEU . 88.8 mt -81.56 112.01 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.362 -0.836 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -105.66 171.7 7.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 64' ' ' GLU . 0.9 OUTLIER -46.62 157.18 0.15 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.514 -0.741 . . . . 0.0 111.268 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' B' ' 64' ' ' GLU . 0.0 OUTLIER 63.81 8.36 3.76 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.791 177.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -71.54 142.36 50.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.018 -1.051 . . . . 0.0 110.153 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 23.4 m -107.77 113.51 26.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.36 -0.837 . . . . 0.0 109.973 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.483 HD23 ' HB2' ' B' ' 45' ' ' PHE . 1.7 mt -102.18 164.18 11.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.33 -0.856 . . . . 0.0 110.048 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -108.58 128.87 55.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.32 -0.863 . . . . 0.0 109.959 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.506 HD22 HD13 ' B' ' 30' ' ' ILE . 48.0 tp -107.02 132.71 52.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.277 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.489 HG22 HD21 ' B' ' 8' ' ' LEU . 41.5 t . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.375 -0.828 . . . . 0.0 110.181 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.339 0.59 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -75.31 -28.44 59.68 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.234 -0.916 . . . . 0.0 109.191 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.66 -36.19 82.06 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.692 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -31.58 68.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -74.58 -42.58 58.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.479 -0.763 . . . . 0.0 109.511 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.2 OUTLIER -78.42 -53.06 7.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.471 -0.768 . . . . 0.0 110.321 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 ttp -53.55 -40.99 66.01 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.204 -0.935 . . . . 0.0 110.524 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.2 m -64.78 -47.38 78.34 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.441 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.6 tp -82.45 -11.69 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.9 . . . . 0.0 110.391 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 31.8 t -72.9 -46.85 50.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 109.8 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -81.85 -26.28 34.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.812 . . . . 0.0 109.908 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.318 -0.864 . . . . 0.0 110.245 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.313 0.578 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.549 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 pt-20 -69.39 -31.08 69.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.484 -0.76 . . . . 0.0 109.114 179.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.456 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.6 OUTLIER -85.27 -39.54 17.62 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -63.92 -46.08 86.39 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -65.63 -34.22 77.73 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.549 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.2 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.71 90.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.506 -0.746 . . . . 0.0 109.722 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -44.56 93.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.419 -0.801 . . . . 0.0 110.051 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.67 -31.1 61.81 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.863 . . . . 0.0 110.361 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.0 tpt -83.42 -24.97 31.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.367 -0.833 . . . . 0.0 110.023 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.0 110.081 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.342 0.592 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -103.07 147.03 27.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.0 110.109 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.703 HD13 HG21 ' B' ' 17' ' ' VAL . 38.3 pt -137.52 158.28 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -111.99 143.84 42.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.598 -0.689 . . . . 0.0 110.613 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 63.8 t -127.89 120.75 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.46 -0.775 . . . . 0.0 109.491 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.1 mtpt -100.03 129.81 46.12 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.409 -0.807 . . . . 0.0 110.568 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.573 HG22 HD23 ' B' ' 69' ' ' LEU . 32.2 p -95.81 175.98 6.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.401 -0.812 . . . . 0.0 110.283 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.442 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.16 -15.97 39.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.794 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.4 p -95.96 20.45 10.03 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.097 -1.002 . . . . 0.0 110.765 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.87 13.78 59.86 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.5 tttp -84.76 130.09 34.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.051 -1.264 . . . . 0.0 109.768 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.1 m -113.05 124.96 53.83 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.143 -0.973 . . . . 0.0 110.439 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 6.5 mt -109.32 133.23 55.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.409 -0.807 . . . . 0.0 110.259 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.7 m -102.38 118.76 37.55 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.371 -0.831 . . . . 0.0 109.564 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 67.9 mt -123.42 168.69 12.22 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.218 -0.926 . . . . 0.0 110.792 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.61 116.03 31.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.399 -0.813 . . . . 0.0 109.642 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.703 HG21 HD13 ' B' ' 3' ' ' ILE . 35.0 m -140.43 169.77 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.696 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.509 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.1 mp0 -112.62 166.07 11.77 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.57 -0.706 . . . . 0.0 109.294 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.16 -25.63 18.82 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 123.538 1.283 . . . . 0.0 110.313 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -84.33 -3.56 58.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.506 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.21 141.41 50.63 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.178 -0.951 . . . . 0.0 110.465 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 46.4 p -83.17 157.13 22.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.54 -0.725 . . . . 0.0 110.367 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.503 HG23 HD12 ' B' ' 43' ' ' LEU . 43.0 mm -59.55 -35.3 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.292 -0.88 . . . . 0.0 109.435 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.16 -37.26 79.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.458 -0.776 . . . . 0.0 109.276 179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.32 -30.15 67.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.553 -0.717 . . . . 0.0 109.296 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 22' ' ' THR . 60.2 t -70.54 -41.44 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.468 -0.77 . . . . 0.0 109.16 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -62.85 -43.82 97.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.403 -0.81 . . . . 0.0 109.151 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -31.71 71.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.73 . . . . 0.0 109.289 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.451 ' HE2' HG12 ' B' ' 17' ' ' VAL . 13.4 mttp -68.35 -40.36 81.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.556 -0.715 . . . . 0.0 109.363 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.8 mt -67.09 -37.56 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.024 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 54.9 tt0 -60.78 -51.76 67.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.376 -0.827 . . . . 0.0 109.631 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.15 -27.1 63.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.433 -0.792 . . . . 0.0 110.592 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.93 -41.72 17.07 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.294 -0.879 . . . . 0.0 110.865 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -108.13 -53.72 2.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.217 -0.927 . . . . 0.0 110.427 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.5 19.74 2.04 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.151 -1.18 . . . . 0.0 110.151 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.489 HG23 ' HD2' ' B' ' 37' ' ' PRO . 51.8 mt -91.39 143.42 28.18 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.108 -1.231 . . . . 0.0 109.823 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -69.69 133.04 24.74 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.663 1.349 . . . . 0.0 110.437 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.84 -25.78 81.86 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 O-C-N 123.705 1.371 . . . . 0.0 110.845 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -68.78 -25.2 64.58 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.304 -0.873 . . . . 0.0 109.88 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 29.5 mm-40 -101.33 5.16 42.19 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.433 -0.792 . . . . 0.0 110.46 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . 0.429 ' HG2' HD11 ' B' ' 69' ' ' LEU . 7.9 mt-30 -94.26 141.82 28.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.0 110.425 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.12 124.46 32.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.447 -0.783 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 28.1 mt -104.6 118.19 35.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.217 -0.927 . . . . 0.0 110.274 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.8 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -120.89 133.04 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.571 -0.706 . . . . 0.0 109.714 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.527 ' HB2' HD23 ' B' ' 67' ' ' LEU . 29.1 t80 -140.87 147.21 38.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.429 -0.794 . . . . 0.0 110.064 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.27 28.79 0.47 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.76 . . . . 0.0 111.191 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.49 2.91 85.72 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -111.13 134.79 52.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.045 -1.268 . . . . 0.0 110.243 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -78.46 134.46 37.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 109.406 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.7 HD12 ' HB3' ' B' ' 43' ' ' LEU . 35.0 mt -83.88 137.07 33.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.239 -0.913 . . . . 0.0 110.361 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -93.76 130.64 39.67 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.791 . . . . 0.0 110.41 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.461 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.39 -26.87 2.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.494 -0.754 . . . . 0.0 111.211 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.81 86.69 Favored Glycine 0 N--CA 1.494 2.547 0 C-N-CA 120.046 -1.073 . . . . 0.0 110.608 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -99.42 156.28 17.1 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.045 -1.268 . . . . 0.0 110.483 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.6 p -102.42 163.84 12.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.373 -0.829 . . . . 0.0 110.158 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.509 HD12 ' O ' ' B' ' 18' ' ' GLU . 85.6 mt -53.5 -44.47 69.11 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.313 -0.867 . . . . 0.0 110.465 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 27.4 p -56.86 -36.31 69.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.398 -0.814 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.59 -27.96 66.73 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.099 -1.001 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.553 ' CD2' HD22 ' B' ' 50' ' ' LEU . 50.4 m-85 -101.13 27.54 6.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 109.93 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 50.6 28.2 3.34 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.604 -0.685 . . . . 0.0 110.683 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.485 HD12 ' HA ' ' B' ' 56' ' ' LEU . 90.9 mt -81.54 108.87 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.93 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.58 174.68 5.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.344 -0.847 . . . . 0.0 110.065 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.56 153.37 0.38 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.465 -0.772 . . . . 0.0 111.022 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 7.6 mt-10 62.64 16.32 8.77 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.667 -0.645 . . . . 0.0 110.681 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.55 142.05 50.08 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 20.3 m -107.64 109.93 21.67 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.334 -0.854 . . . . 0.0 110.115 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.527 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.2 mt -102.54 160.72 14.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.84 . . . . 0.0 110.101 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -108.83 132.66 53.79 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.306 -0.871 . . . . 0.0 110.043 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.573 HD23 HG22 ' B' ' 7' ' ' THR . 54.7 tp -107.28 129.38 54.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.305 -0.872 . . . . 0.0 110.184 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.46 -0.775 . . . . 0.0 110.071 179.863 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t70 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.219 0.533 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -77.67 -28.67 51.2 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.183 -0.948 . . . . 0.0 109.517 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.26 79.89 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.414 -0.915 . . . . 0.0 108.786 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 70' ' ' THR . 14.1 tp -73.04 -30.94 64.11 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -77.55 -34.35 53.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.595 -0.69 . . . . 0.0 109.669 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.47 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -84.63 -51.29 6.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 109.926 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.33 -38.62 63.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.275 -0.891 . . . . 0.0 110.425 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 66' ' ' LEU . 14.4 t -74.59 -36.27 63.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.243 -0.911 . . . . 0.0 110.474 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.47 HG22 ' HA ' ' A' ' 68' ' ' LYS . 3.4 tp -85.45 -14.01 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.387 -0.821 . . . . 0.0 110.323 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' LYS . 35.5 t -83.82 -33.41 24.93 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.926 . . . . 0.0 109.992 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.86 -24.31 19.38 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.299 -0.876 . . . . 0.0 110.185 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.32 -0.863 . . . . 0.0 110.232 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.489 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 77.4 p . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.421 0.629 . . . . 0.0 110.426 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.58 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 2.8 mt-10 -73.53 -29.85 62.72 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.559 -0.713 . . . . 0.0 109.077 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.44 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 31.7 mt-10 -85.09 -36.97 20.81 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.489 ' HB2' ' N ' ' A' ' 88' ' ' THR . 7.8 mm-40 -66.19 -45.27 81.42 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -66.47 -34.79 78.73 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.58 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -65.61 -36.24 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 178.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.41 71.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.494 -0.754 . . . . 0.0 109.613 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -84.52 -46.13 11.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.462 -0.774 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.44 -30.92 67.89 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.417 -0.802 . . . . 0.0 110.505 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.4 ttm -82.3 -25.52 33.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.285 -0.884 . . . . 0.0 109.971 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 . . . . . 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 110.147 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.137 0.494 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.24 140.71 29.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.797 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.8 pt -137.38 159.79 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.906 . . . . 0.0 110.291 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.98 143.62 42.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.576 -0.703 . . . . 0.0 110.686 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 82.4 t -127.72 116.87 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.447 -0.783 . . . . 0.0 109.352 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.616 ' HG3' HG23 ' B' ' 12' ' ' THR . 13.4 mttt -100.18 131.87 45.87 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.345 -0.847 . . . . 0.0 110.813 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.433 HG22 HD23 ' B' ' 69' ' ' LEU . 17.5 p -95.99 173.34 7.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.878 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.402 HD11 HG13 ' B' ' 70' ' ' VAL . 8.6 mt -61.66 -12.01 14.31 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.343 -0.848 . . . . 0.0 110.941 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 63.8 p -95.65 16.06 18.31 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.036 -1.04 . . . . 0.0 110.767 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.36 8.59 66.46 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 120.195 -1.003 . . . . 0.0 110.629 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 11.6 tttt -84.75 127.27 34.03 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.052 -1.264 . . . . 0.0 109.905 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.616 HG23 ' HG3' ' B' ' 6' ' ' LYS . 3.5 m -113.24 126.84 55.85 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.977 . . . . 0.0 110.495 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 13.1 mt -109.46 136.67 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.358 -0.839 . . . . 0.0 110.439 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m -102.3 120.52 40.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.1 mt -123.49 162.22 23.31 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.117 -0.99 . . . . 0.0 110.857 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -106.55 116.15 31.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.475 -0.765 . . . . 0.0 109.664 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.24 176.45 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 110.787 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.408 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -113.14 163.24 18.62 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.689 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.44 -26.69 20.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.513 1.27 . . . . 0.0 110.276 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 m -84.54 -2.48 57.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.261 -0.9 . . . . 0.0 110.614 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -71.36 145.15 49.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.541 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.33 156.33 23.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.661 -0.65 . . . . 0.0 110.432 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.451 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.7 mm -59.61 -32.75 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 109.431 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -62.58 -36.74 83.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -70.21 -31.51 68.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.514 -0.742 . . . . 0.0 109.124 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.99 -40.37 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttt -62.92 -40.6 98.12 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -34.75 76.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 109.348 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.9 -39.99 83.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.571 -0.706 . . . . 0.0 109.554 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.0 mt -67.31 -37.62 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.152 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.4 tm0? -60.87 -53.33 58.62 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.469 -0.769 . . . . 0.0 109.833 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.1 -27.73 63.98 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.386 -0.821 . . . . 0.0 110.746 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -84.12 -36.52 22.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 111.167 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -108.07 -53.14 2.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.202 -0.936 . . . . 0.0 110.602 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.61 14.15 3.6 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.471 HG23 ' HD2' ' B' ' 37' ' ' PRO . 69.2 mt -91.37 143.25 27.94 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.107 -1.231 . . . . 0.0 109.874 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.544 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 38.7 Cg_endo -67.4 135.39 36.43 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.61 1.321 . . . . 0.0 110.391 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 -24.74 79.32 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.727 1.383 . . . . 0.0 111.001 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.73 -25.38 64.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.317 -0.865 . . . . 0.0 109.804 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.544 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.58 6.87 44.27 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.533 -0.73 . . . . 0.0 110.541 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -94.3 139.52 30.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.445 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.1 122.82 29.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.452 -0.78 . . . . 0.0 109.845 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.793 ' HB3' HD12 ' B' ' 50' ' ' LEU . 28.0 mt -104.7 116.69 32.47 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.481 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.786 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.12 133.78 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.553 -0.717 . . . . 0.0 109.658 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -140.39 151.64 45.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.458 -0.776 . . . . 0.0 109.807 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.38 28.14 0.44 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.472 -0.768 . . . . 0.0 111.048 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.52 2.31 79.72 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -111.13 138.3 47.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.246 . . . . 0.0 110.292 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -78.39 135.88 37.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.9 . . . . 0.0 109.459 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.793 HD12 ' HB3' ' B' ' 43' ' ' LEU . 39.8 mt -83.79 138.45 33.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 110.315 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -93.67 127.76 39.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.387 -0.821 . . . . 0.0 110.6 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.33 -26.42 2.02 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 111.135 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -10.45 82.95 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.733 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.25 158.3 15.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.31 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 41.3 p -102.39 166.15 10.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.768 . . . . 0.0 110.373 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.504 ' HA ' HD12 ' B' ' 61' ' ' ILE . 55.4 mt -53.64 -44.21 69.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.317 -0.864 . . . . 0.0 110.751 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 94.0 p -56.83 -36.77 70.36 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.342 -0.849 . . . . 0.0 111.153 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.55 -27.06 65.89 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.135 -0.978 . . . . 0.0 110.532 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.582 ' CD2' HD22 ' B' ' 50' ' ' LEU . 55.2 m-85 -101.06 24.72 8.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.883 . . . . 0.0 110.221 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 50.69 30.33 4.86 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.4 -0.813 . . . . 0.0 110.723 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.528 HD13 HD21 ' B' ' 67' ' ' LEU . 73.5 mt -81.67 113.45 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.29 -0.881 . . . . 0.0 110.015 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.78 170.47 7.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.9 . . . . 0.0 110.262 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.74 153.28 0.41 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.568 -0.707 . . . . 0.0 111.103 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.84 16.1 8.8 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.611 -0.68 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.56 144.59 49.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.153 -0.967 . . . . 0.0 110.082 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.7 m -107.53 110.49 22.43 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.528 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.42 162.62 12.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.368 -0.832 . . . . 0.0 110.213 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -109.03 130.58 55.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.363 -0.835 . . . . 0.0 109.941 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.433 HD23 HG22 ' B' ' 7' ' ' THR . 55.0 tp -106.97 127.75 53.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.402 HG13 HD11 ' B' ' 8' ' ' LEU . 48.6 t . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.303 -0.873 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.218 0.532 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -75.9 -29.78 58.58 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.239 -0.913 . . . . 0.0 109.163 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.84 -36.29 82.73 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.434 -0.906 . . . . 0.0 108.69 179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -29.09 64.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.489 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.5 tt -78.73 -37.68 40.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.51 -0.744 . . . . 0.0 109.803 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.436 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.04 -50.71 7.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.5 -0.75 . . . . 0.0 110.38 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.3 tpp -57.64 -42.97 84.52 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.264 -0.898 . . . . 0.0 110.438 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.8 m -68.35 -41.73 80.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.337 -0.852 . . . . 0.0 110.571 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.436 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.3 tp -82.95 -14.98 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.253 -0.904 . . . . 0.0 110.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' LYS . 8.2 t -74.15 -45.33 49.43 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.889 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -79.59 -26.42 41.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.44 -0.788 . . . . 0.0 109.956 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.347 -0.846 . . . . 0.0 110.153 179.907 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.365 0.602 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.1 mt-10 -71.92 -30.32 65.23 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.462 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mm-40 -83.85 -38.07 21.66 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -45.24 85.3 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.07 -34.2 77.52 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.557 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -67.37 -33.67 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.74 -28.9 69.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.398 -0.814 . . . . 0.0 109.8 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.78 -39.31 20.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.411 -0.806 . . . . 0.0 110.355 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.95 -29.3 32.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.282 -0.886 . . . . 0.0 110.724 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 tpt -82.27 -27.47 32.38 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 . . . . . 0 N--CA 1.488 1.433 0 O-C-N 121.478 -0.764 . . . . 0.0 109.764 179.695 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.479 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.0 ttp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.213 0.53 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -88.21 138.69 31.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 109.855 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.6 pt -137.42 158.82 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.343 -0.848 . . . . 0.0 110.365 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -111.84 142.55 44.07 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.616 -0.677 . . . . 0.0 110.628 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t -127.97 119.59 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.383 -0.823 . . . . 0.0 109.507 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.453 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.7 mtpm? -100.32 131.15 46.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.803 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.2 p -96.21 176.86 5.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 110.18 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.62 -15.08 36.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.449 -0.782 . . . . 0.0 110.954 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 78.0 p -95.8 19.88 10.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.041 -1.037 . . . . 0.0 110.767 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.91 12.83 58.26 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.06 34.86 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.242 . . . . 0.0 109.729 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 25.1 m -112.88 126.75 55.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.273 -0.892 . . . . 0.0 110.42 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.3 mt -109.31 138.54 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.39 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.3 m -101.93 119.71 39.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.0 109.13 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.405 HD23 ' HE3' ' B' ' 33' ' ' LYS . 30.0 mt -123.47 160.68 26.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.055 -178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 114.91 29.32 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.527 -0.733 . . . . 0.0 109.409 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.479 ' O ' ' HB3' ' B' ' 1' ' ' MET . 28.4 m -140.16 176.99 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 110.882 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.483 ' O ' HD12 ' B' ' 56' ' ' LEU . 5.5 mt-10 -113.29 164.21 16.26 Favored Pre-proline 0 N--CA 1.49 1.536 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.9 -26.07 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 123.543 1.286 . . . . 0.0 110.346 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 -3.13 58.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.212 -0.93 . . . . 0.0 110.739 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.27 144.1 50.14 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.139 -0.976 . . . . 0.0 110.617 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 67.5 p -83.15 158.48 22.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.535 -0.728 . . . . 0.0 110.206 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.854 HG23 HD12 ' B' ' 43' ' ' LEU . 43.7 mm -59.58 -36.97 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 109.542 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.74 -35.46 76.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.453 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -70.44 -32.99 70.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.468 -0.77 . . . . 0.0 109.351 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.94 -39.8 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.0 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.412 ' HE2' HG22 ' B' ' 23' ' ' ILE . 18.6 mtmt -62.99 -41.19 99.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 109.036 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.42 77.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.573 -0.704 . . . . 0.0 109.391 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -37.5 81.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.437 -0.789 . . . . 0.0 109.388 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.4 mt -67.18 -37.46 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.769 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -60.71 -51.28 70.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.549 -0.719 . . . . 0.0 109.531 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -58.13 -27.25 63.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.55 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.405 ' HE3' HD23 ' B' ' 15' ' ' LEU . 21.3 mmtt -84.07 -39.47 19.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.214 -0.929 . . . . 0.0 110.841 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -108.16 -55.75 2.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.249 -0.907 . . . . 0.0 110.6 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.2 14.24 2.03 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.496 HG23 ' HD2' ' B' ' 37' ' ' PRO . 13.8 mt -91.17 143.81 28.95 Favored Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.115 -1.227 . . . . 0.0 109.573 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.7 Cg_endo -68.38 131.74 23.99 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 O-C-N 123.631 1.332 . . . . 0.0 110.6 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.01 -25.41 81.44 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.719 1.378 . . . . 0.0 110.777 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -68.69 -24.13 64.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 109.768 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -101.19 2.59 40.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.455 -0.778 . . . . 0.0 110.427 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -94.35 141.95 27.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.234 -0.916 . . . . 0.0 110.473 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.36 131.77 45.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.529 -0.732 . . . . 0.0 109.801 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.854 HD12 HG23 ' B' ' 23' ' ' ILE . 18.2 mt -104.62 120.86 42.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.349 -0.844 . . . . 0.0 110.467 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.801 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.08 133.01 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.496 -0.753 . . . . 0.0 109.65 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.532 ' HB2' HD23 ' B' ' 67' ' ' LEU . 40.1 t80 -140.65 150.66 43.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.416 -0.803 . . . . 0.0 110.16 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.68 0.46 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.457 -0.777 . . . . 0.0 111.217 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.51 2.48 80.27 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -110.97 137.46 48.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.968 -1.313 . . . . 0.0 110.239 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.49 134.35 37.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.397 -0.814 . . . . 0.0 109.688 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.809 HD12 ' HB3' ' B' ' 43' ' ' LEU . 31.9 mt -83.8 141.04 31.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.232 -0.917 . . . . 0.0 110.306 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -93.49 129.32 39.73 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.358 -0.839 . . . . 0.0 110.524 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 73.1 m-20 -48.29 -26.11 1.86 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.734 . . . . 0.0 111.229 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.78 -9.31 84.72 Favored Glycine 0 N--CA 1.493 2.482 0 C-N-CA 120.139 -1.029 . . . . 0.0 110.553 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -99.35 156.8 16.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.994 -1.297 . . . . 0.0 110.483 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 31.8 p -102.38 167.65 9.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 110.181 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.604 ' HA ' HD12 ' B' ' 61' ' ' ILE . 86.6 mt -53.69 -47.02 70.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.255 -0.903 . . . . 0.0 110.629 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.76 -34.71 67.85 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.368 -0.833 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.63 -29.46 68.03 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.152 -0.967 . . . . 0.0 110.384 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.636 ' CG ' HD22 ' B' ' 50' ' ' LEU . 47.3 m-85 -101.24 28.97 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.835 . . . . 0.0 109.867 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.69 28.43 3.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.593 -0.692 . . . . 0.0 110.785 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.604 HD12 ' HA ' ' B' ' 56' ' ' LEU . 97.4 mt -81.36 108.54 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 109.741 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -105.73 173.53 6.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.379 -0.826 . . . . 0.0 110.366 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.4 OUTLIER -46.55 152.36 0.47 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.526 -0.734 . . . . 0.0 110.933 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.6 mm-40 62.97 15.87 8.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.701 -0.624 . . . . 0.0 110.59 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 144.93 49.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 0.0 110.079 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -107.56 106.83 17.38 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.33 -0.856 . . . . 0.0 109.929 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.532 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.4 mt -102.57 160.49 14.52 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.6 m80 -108.88 135.91 49.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -0.885 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.2 tp -107.13 131.65 53.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.291 -0.881 . . . . 0.0 110.411 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 19.4 t . . . . . 0 N--CA 1.493 1.691 0 O-C-N 121.395 -0.816 . . . . 0.0 110.121 179.894 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.293 0.568 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.38 -32.48 58.59 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.205 -0.934 . . . . 0.0 109.21 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.69 80.86 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 108.901 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mp -70.16 -30.68 67.88 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.648 ' O ' HD13 ' A' ' 67' ' ' LEU . 3.1 tm? -73.87 -42.95 60.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.453 -0.779 . . . . 0.0 109.46 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -80.41 -53.25 6.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.424 -0.797 . . . . 0.0 110.599 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -53.77 -38.51 64.51 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.109 -0.995 . . . . 0.0 110.623 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 47.3 m -70.31 -41.36 73.4 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.264 -0.898 . . . . 0.0 110.494 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.446 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.8 tp -84.34 -14.55 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.173 -0.954 . . . . 0.0 110.368 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -75.66 -44.67 41.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.284 -0.885 . . . . 0.0 109.658 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -79.06 -27.04 43.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.483 -0.761 . . . . 0.0 109.967 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 . . . . . 0 N--CA 1.493 1.677 0 O-C-N 121.359 -0.838 . . . . 0.0 110.229 179.937 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.35 0.595 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.58 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.5 pt-20 -66.07 -33.55 76.04 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.445 -0.784 . . . . 0.0 109.456 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.431 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 29.2 mt-10 -85.2 -39.73 17.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.662 -0.649 . . . . 0.0 109.543 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.12 -41.67 90.21 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -69.98 -34.63 73.61 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.58 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -58.76 -34.97 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.71 61.88 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.57 -0.706 . . . . 0.0 109.519 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.71 -34.12 77.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.519 -0.738 . . . . 0.0 109.943 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.77 -37.2 41.64 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.411 -0.805 . . . . 0.0 110.071 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.7 tpp -81.15 -25.95 36.46 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.286 -0.884 . . . . 0.0 109.79 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.489 1.481 0 O-C-N 121.414 -0.804 . . . . 0.0 109.82 179.88 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.458 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 39.3 ttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.339 0.59 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -120.44 139.17 53.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.486 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.529 HD13 HG21 ' B' ' 17' ' ' VAL . 45.0 pt -137.55 158.33 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.223 -0.923 . . . . 0.0 110.514 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -111.78 145.56 39.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.608 -0.683 . . . . 0.0 110.297 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' B' ' 12' ' ' THR . 60.7 t -128.18 122.63 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.373 -0.829 . . . . 0.0 109.844 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.434 ' HG3' HG23 ' B' ' 12' ' ' THR . 0.1 OUTLIER -100.13 135.9 40.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.358 -0.839 . . . . 0.0 110.182 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.2 p -95.67 171.52 8.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.39 -0.819 . . . . 0.0 110.583 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.477 HD21 HG22 ' B' ' 70' ' ' VAL . 4.5 mm? -61.26 -13.28 17.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.506 -0.746 . . . . 0.0 111.192 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 75.8 p -95.44 -21.06 18.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.119 -0.988 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.89 9.2 14.16 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.941 -1.123 . . . . 0.0 110.394 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 131.76 34.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.071 -1.252 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.434 HG23 ' HG3' ' B' ' 6' ' ' LYS . 1.8 m -113.02 122.24 47.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.121 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mt -109.11 137.0 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.401 -0.812 . . . . 0.0 110.335 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.1 m -102.11 122.14 43.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.516 HD11 HG12 ' B' ' 30' ' ' ILE . 82.5 mt -123.44 161.45 24.78 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.171 -0.955 . . . . 0.0 110.806 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -106.25 116.12 31.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.534 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.529 HG21 HD13 ' B' ' 3' ' ' ILE . 34.9 m -140.03 179.12 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.336 -0.853 . . . . 0.0 110.627 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.569 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.4 mp0 -113.12 165.18 13.75 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.495 -0.753 . . . . 0.0 109.29 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.51 -27.59 15.49 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.593 1.312 . . . . 0.0 110.338 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.44 -2.34 57.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.214 -0.928 . . . . 0.0 110.494 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -71.21 143.27 50.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.23 -0.919 . . . . 0.0 110.44 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 82.5 p -83.22 160.33 21.8 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.513 -0.742 . . . . 0.0 110.261 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.435 HG13 ' HB3' ' B' ' 50' ' ' LEU . 48.4 mm -59.83 -38.16 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.41 -33.43 72.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 109.365 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -70.32 -35.27 73.54 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.537 -0.727 . . . . 0.0 109.217 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.65 -37.17 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.458 -0.776 . . . . 0.0 108.926 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -63.08 -42.16 99.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.445 -0.784 . . . . 0.0 108.922 178.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.19 75.1 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.606 -0.684 . . . . 0.0 109.325 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.496 ' HE3' HG12 ' B' ' 17' ' ' VAL . 14.4 mttt -68.35 -38.55 81.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.464 -0.773 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.516 HG12 HD11 ' B' ' 15' ' ' LEU . 10.9 mt -67.26 -40.93 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 109.223 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -48.68 80.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.421 -0.8 . . . . 0.0 109.497 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.89 -28.03 63.84 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.505 -0.747 . . . . 0.0 110.206 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -83.53 -42.66 16.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 110.146 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -108.33 -118.18 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.444 -0.785 . . . . 0.0 109.743 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.8 23.93 0.22 Allowed Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.783 -1.199 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.458 HG23 ' HD2' ' B' ' 37' ' ' PRO . 81.7 mt -91.88 142.2 26.26 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.205 -1.173 . . . . 0.0 110.21 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -69.48 134.15 27.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.698 1.367 . . . . 0.0 110.269 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.74 -26.32 82.77 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.717 1.377 . . . . 0.0 110.84 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.79 -24.98 64.48 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.305 -0.872 . . . . 0.0 109.941 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 30.9 mt-30 -101.27 7.38 42.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 110.514 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -94.38 138.05 32.8 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.483 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.415 ' C ' HD22 ' B' ' 43' ' ' LEU . 2.7 ttm180 -130.32 127.81 40.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.449 -0.782 . . . . 0.0 109.627 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD12 ' B' ' 50' ' ' LEU . 4.4 mm? -104.49 125.01 50.28 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.35 -0.844 . . . . 0.0 110.609 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.42 ' O ' ' CD2' ' B' ' 68' ' ' HIS . 1.6 mt -122.25 141.11 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.566 -0.709 . . . . 0.0 110.31 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.664 ' HB3' HD21 ' B' ' 50' ' ' LEU . 47.1 t80 -141.65 148.2 38.76 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.25 0.3 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.511 -0.743 . . . . 0.0 111.482 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.21 1.99 90.27 Favored Glycine 0 N--CA 1.495 2.617 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.743 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -110.8 141.89 43.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.924 -1.339 . . . . 0.0 110.296 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -78.35 132.54 37.45 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 109.784 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.664 HD21 ' HB3' ' B' ' 45' ' ' PHE . 17.9 mt -84.05 142.79 30.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.232 -0.917 . . . . 0.0 110.08 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -93.45 132.75 37.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.358 -0.839 . . . . 0.0 110.406 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.41 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.42 -30.45 5.08 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.55 -0.719 . . . . 0.0 111.019 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.81 -2.66 90.67 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.54 153.73 18.81 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.101 -1.235 . . . . 0.0 110.343 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.8 p -102.19 164.18 11.83 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.85 . . . . 0.0 110.103 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.628 ' HA ' HD12 ' B' ' 61' ' ' ILE . 83.7 mt -53.58 -47.3 70.25 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.297 -0.877 . . . . 0.0 110.683 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 17.8 p -56.8 -36.04 69.45 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.396 -0.815 . . . . 0.0 111.214 -179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.44 -28.91 67.4 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.124 -0.985 . . . . 0.0 110.403 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.651 ' CD2' HD22 ' B' ' 50' ' ' LEU . 35.9 m-85 -101.19 28.32 5.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.419 -0.8 . . . . 0.0 109.908 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 50.77 28.45 3.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.596 -0.69 . . . . 0.0 110.669 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' B' ' 56' ' ' LEU . 92.4 mt -81.4 108.88 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.253 -0.904 . . . . 0.0 109.764 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -105.45 173.28 6.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.388 -0.82 . . . . 0.0 110.348 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.3 ptmt -46.76 152.77 0.45 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.504 -0.748 . . . . 0.0 111.085 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 63.17 14.98 8.17 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.805 -0.559 . . . . 0.0 111.012 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -71.5 145.25 49.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.012 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . 0.402 ' C ' HD22 ' B' ' 67' ' ' LEU . 86.5 m -107.6 109.8 21.53 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.416 -0.803 . . . . 0.0 109.987 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.693 HD22 ' N ' ' B' ' 67' ' ' LEU . 2.9 mm? -102.47 160.53 14.47 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.309 -0.87 . . . . 0.0 110.134 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' B' ' 44' ' ' ILE . 9.1 m-70 -108.64 134.62 51.13 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.3 -0.875 . . . . 0.0 109.688 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.41 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 35.8 tp -107.15 127.57 53.62 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 110.129 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.477 HG22 HD21 ' B' ' 8' ' ' LEU . 44.2 t . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.435 -0.791 . . . . 0.0 110.02 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.139 0.495 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -78.52 -32.28 47.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.212 -0.93 . . . . 0.0 109.131 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.79 -44.67 96.51 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.823 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.43 -29.56 70.61 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.45 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.2 tt -75.49 -37.92 59.85 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.518 -0.739 . . . . 0.0 109.785 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -82.81 -55.43 4.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 110.476 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 ttt -52.87 -41.61 64.47 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 110.687 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 83.7 m -69.01 -40.85 78.43 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.315 -0.866 . . . . 0.0 110.508 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 68' ' ' LYS . 4.1 tp -80.07 -18.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.959 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.93 -38.24 69.89 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.324 -0.86 . . . . 0.0 109.535 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -79.21 -31.78 43.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.461 -0.775 . . . . 0.0 109.673 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.451 -0.781 . . . . 0.0 109.865 179.583 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.2 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.401 0.62 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.53 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 9.6 pt-20 -67.71 -32.23 72.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.468 -0.77 . . . . 0.0 109.258 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 32.7 mt-10 -85.35 -39.74 17.3 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.81 -44.78 92.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -66.13 -35.7 81.19 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.37 -33.79 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 178.856 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.76 -48.64 78.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 109.875 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -38.52 65.62 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.42 -0.8 . . . . 0.0 109.698 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.2 -37.89 86.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.446 -0.784 . . . . 0.0 109.992 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.5 ttm -80.66 -26.96 37.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.357 -0.839 . . . . 0.0 109.704 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 O-C-N 121.498 -0.751 . . . . 0.0 109.877 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.6 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.164 0.507 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -90.51 139.45 30.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.439 -0.788 . . . . 0.0 109.843 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -137.25 158.43 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.264 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.77 145.11 39.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.646 . . . . 0.0 110.671 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.7 t -128.03 119.44 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 109.53 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.0 mtmp? -100.26 129.85 46.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.361 -0.837 . . . . 0.0 110.686 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.2 p -96.4 174.81 6.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.437 -0.79 . . . . 0.0 110.067 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mt -61.62 -13.56 23.21 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.312 -0.868 . . . . 0.0 110.841 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 79.0 p -95.57 19.02 11.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.106 -0.997 . . . . 0.0 110.565 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.88 11.57 58.24 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.2 OUTLIER -84.84 128.28 34.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.068 -1.254 . . . . 0.0 109.952 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.4 m -113.09 124.43 52.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.883 . . . . 0.0 110.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mt -109.14 136.88 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.48 -0.762 . . . . 0.0 110.288 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 12.0 m -102.29 120.78 41.06 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.529 -0.732 . . . . 0.0 109.502 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 69.8 mt -123.38 162.93 21.8 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 110.963 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.3 115.71 30.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.537 -0.727 . . . . 0.0 109.347 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.25 174.85 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.285 -0.885 . . . . 0.0 110.863 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.453 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.5 mm-40 -113.14 165.5 13.08 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.41 -24.98 22.01 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 123.507 1.267 . . . . 0.0 110.385 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.0 p -84.6 -4.62 59.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 110.474 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -71.26 139.11 49.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.175 -0.953 . . . . 0.0 110.683 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 57.6 p -83.67 160.21 21.38 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.51 -0.744 . . . . 0.0 110.495 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.892 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.48 -34.88 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.346 -0.846 . . . . 0.0 109.705 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.31 -37.26 80.02 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.371 -0.83 . . . . 0.0 109.386 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -31.48 68.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.463 -0.773 . . . . 0.0 109.203 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . 0.408 HG23 ' O ' ' B' ' 22' ' ' THR . 58.1 t -69.92 -41.64 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.515 -0.741 . . . . 0.0 109.078 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.62 ' HD2' HG22 ' B' ' 23' ' ' ILE . 4.4 mttp -62.88 -38.95 92.94 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.437 -0.789 . . . . 0.0 108.947 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.79 -36.18 80.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.488 -0.757 . . . . 0.0 109.346 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.42 ' HD3' HG12 ' B' ' 17' ' ' VAL . 7.0 mttm -68.28 -39.7 82.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.603 HD13 HD22 ' B' ' 69' ' ' LEU . 12.5 mt -66.92 -38.87 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.211 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.67 -50.63 72.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.476 -0.765 . . . . 0.0 109.578 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.87 -26.42 62.09 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.401 -0.812 . . . . 0.0 110.236 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -84.27 -40.46 17.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.807 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.99 -55.54 2.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.441 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.19 17.76 1.96 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.522 HG23 ' HD2' ' B' ' 37' ' ' PRO . 81.1 mt -91.45 144.52 29.78 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.157 -1.202 . . . . 0.0 109.791 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.522 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.9 Cg_endo -70.13 133.48 24.99 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.552 1.291 . . . . 0.0 110.417 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.97 -27.48 84.85 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.736 1.387 . . . . 0.0 111.046 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.83 -22.39 64.24 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.396 -0.815 . . . . 0.0 110.336 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 41.9 mm-40 -101.29 -2.29 31.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.313 -0.867 . . . . 0.0 110.646 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -94.35 143.42 26.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.215 -0.928 . . . . 0.0 110.397 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -130.09 132.19 46.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.942 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.892 HD12 HG23 ' B' ' 23' ' ' ILE . 20.1 mt -104.74 119.54 39.25 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.355 -0.84 . . . . 0.0 110.369 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.792 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.17 134.71 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.503 -0.748 . . . . 0.0 109.907 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.51 ' HB2' HD23 ' B' ' 67' ' ' LEU . 37.2 t80 -141.49 154.53 45.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.548 -0.72 . . . . 0.0 110.007 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.431 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.1 25.56 0.18 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.539 -0.725 . . . . 0.0 111.513 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.34 -4.93 75.14 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.777 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.77 142.84 42.21 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.04 -1.271 . . . . 0.0 110.47 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.71 138.4 38.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.351 -0.843 . . . . 0.0 109.779 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.744 HD12 ' HB3' ' B' ' 43' ' ' LEU . 40.7 mt -84.3 148.4 26.69 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.304 -0.872 . . . . 0.0 109.998 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -93.51 125.95 38.4 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.327 -0.858 . . . . 0.0 110.394 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -48.54 -32.49 8.08 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.362 -0.836 . . . . 0.0 110.984 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.69 -1.85 90.58 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 31.9 mmt-85 -99.57 157.88 16.14 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.066 -1.255 . . . . 0.0 110.29 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.5 p -102.55 162.22 13.09 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.591 ' HA ' HD12 ' B' ' 61' ' ' ILE . 93.7 mt -53.37 -45.38 69.17 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.279 -0.888 . . . . 0.0 110.649 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.87 -36.7 70.38 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.085 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.63 -27.69 66.56 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.187 -0.946 . . . . 0.0 110.361 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.48 ' CD2' HD22 ' B' ' 50' ' ' LEU . 36.9 m-85 -101.09 27.59 5.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.348 -0.845 . . . . 0.0 109.931 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 50.88 28.03 3.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.464 -0.773 . . . . 0.0 110.716 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' B' ' 56' ' ' LEU . 85.9 mt -81.43 112.04 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.349 -0.845 . . . . 0.0 109.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.63 173.02 6.49 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.38 -0.825 . . . . 0.0 110.448 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.8 pttm -46.65 154.16 0.33 Allowed 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.492 0.663 . . . . 0.0 111.177 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.4 mt-10 62.58 15.61 8.09 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.749 -0.594 . . . . 0.0 110.805 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 141.57 49.9 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.179 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.8 m -107.61 110.63 22.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.292 -0.88 . . . . 0.0 109.945 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.51 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.2 mt -102.76 161.47 13.71 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.313 -0.867 . . . . 0.0 110.008 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -108.8 131.64 54.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.306 -0.871 . . . . 0.0 109.951 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.603 HD22 HD13 ' B' ' 30' ' ' ILE . 61.9 tp -106.98 133.85 51.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.217 -0.927 . . . . 0.0 110.551 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 45.1 t . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.35 -0.844 . . . . 0.0 110.205 179.854 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.215 0.531 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -74.77 -27.5 60.36 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.215 -0.928 . . . . 0.0 109.175 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -43.84 97.88 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.874 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.95 -29.15 69.5 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -77.42 -36.84 52.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.529 -0.732 . . . . 0.0 109.866 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.3 -54.77 4.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.399 -0.813 . . . . 0.0 110.499 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.7 mmt -54.44 -43.05 71.25 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.148 -0.97 . . . . 0.0 110.627 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.5 m -69.62 -40.4 76.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.272 -0.892 . . . . 0.0 110.621 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.409 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.0 tp -82.17 -15.96 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.154 -0.966 . . . . 0.0 110.221 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 68' ' ' LYS . 27.5 t -74.77 -42.89 57.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.876 . . . . 0.0 109.791 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -79.25 -27.02 42.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.528 -0.733 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.389 -0.819 . . . . 0.0 110.017 179.899 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.36 0.6 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.3 pt-20 -68.52 -31.68 71.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.521 -0.737 . . . . 0.0 109.196 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.4 mt-10 -85.57 -40.04 16.72 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.25 -44.73 94.32 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -67.35 -34.18 76.78 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -66.38 -34.86 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.73 -46.0 90.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.514 -0.741 . . . . 0.0 110.238 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -40.19 29.87 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.367 -0.833 . . . . 0.0 109.949 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.91 79.21 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.349 -0.844 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 tpp -83.88 -24.39 30.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.361 -0.837 . . . . 0.0 110.097 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.298 -0.876 . . . . 0.0 110.228 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.333 0.587 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -98.2 147.6 24.44 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.136 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.691 HD13 HG21 ' B' ' 17' ' ' VAL . 34.7 pt -137.63 157.72 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.334 -0.854 . . . . 0.0 110.076 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.41 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 80.5 m-85 -111.94 143.08 43.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.588 -0.695 . . . . 0.0 110.663 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' B' ' 12' ' ' THR . 95.7 t -127.83 119.74 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.49 -0.756 . . . . 0.0 109.455 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 18.7 mttt -100.08 136.75 39.5 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.409 -0.807 . . . . 0.0 110.743 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 73.4 p -96.17 171.13 8.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.437 -0.789 . . . . 0.0 110.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.82 -10.49 9.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.397 -0.814 . . . . 0.0 111.24 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.5 p -95.55 -18.49 20.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.933 -1.105 . . . . 0.0 110.631 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.99 7.4 25.23 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 9.5 tttt -84.61 129.87 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.083 -1.245 . . . . 0.0 109.811 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 7.5 m -113.14 126.1 55.07 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.232 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.4 mt -109.23 136.21 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.432 -0.792 . . . . 0.0 110.489 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.41 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 19.2 m -102.41 119.78 39.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.457 -0.777 . . . . 0.0 109.409 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.422 HD11 HG12 ' B' ' 30' ' ' ILE . 80.3 mt -123.51 166.85 14.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -106.52 114.31 28.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.804 . . . . 0.0 109.48 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.691 HG21 HD13 ' B' ' 3' ' ' ILE . 33.8 m -140.52 169.34 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 110.951 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.427 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.0 OUTLIER -112.61 165.12 13.72 Favored Pre-proline 0 N--CA 1.488 1.474 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -71.67 -24.73 21.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.466 1.245 . . . . 0.0 110.375 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.45 -5.67 59.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 110.531 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -71.24 143.48 50.4 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.265 -0.897 . . . . 0.0 110.721 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.4 p -83.3 159.52 21.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.588 -0.695 . . . . 0.0 110.391 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.585 HG23 HD12 ' B' ' 43' ' ' LEU . 43.5 mm -59.64 -36.33 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 109.647 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.83 -35.91 77.73 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 109.424 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -70.29 -33.15 71.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.538 -0.726 . . . . 0.0 109.393 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.1 t -70.15 -39.74 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.172 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -62.86 -43.49 98.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.475 -0.766 . . . . 0.0 109.166 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.35 -32.98 72.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.509 -0.744 . . . . 0.0 109.309 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.549 ' CD ' HG12 ' B' ' 17' ' ' VAL . 34.9 mttm -68.28 -39.36 82.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.479 -0.763 . . . . 0.0 109.473 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.422 HG12 HD11 ' B' ' 15' ' ' LEU . 10.2 mt -67.26 -38.69 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.369 -0.832 . . . . 0.0 109.09 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.5 OUTLIER -60.53 -50.67 72.64 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.491 179.108 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.19 -26.7 63.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.404 -0.81 . . . . 0.0 110.33 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.9 mmtm -83.85 -40.91 18.08 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.287 -0.883 . . . . 0.0 110.801 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -108.08 -55.57 2.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.244 -0.91 . . . . 0.0 110.449 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.36 18.59 1.82 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.479 HG23 ' HD2' ' B' ' 37' ' ' PRO . 18.3 mt -91.31 143.52 28.4 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.071 -1.252 . . . . 0.0 109.69 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.479 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -68.0 133.84 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 O-C-N 123.65 1.342 . . . . 0.0 110.387 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.91 -26.48 83.19 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.65 1.342 . . . . 0.0 110.756 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.0 64.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.325 -0.86 . . . . 0.0 110.061 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 23.1 mt-30 -101.23 -0.9 35.01 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.37 -0.831 . . . . 0.0 110.629 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -94.17 140.39 29.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.163 -0.96 . . . . 0.0 110.243 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -130.08 130.43 44.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.457 -0.777 . . . . 0.0 109.956 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.923 ' HB3' HD12 ' B' ' 50' ' ' LEU . 23.1 mt -104.59 116.91 32.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.404 -0.81 . . . . 0.0 110.441 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.782 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.7 mp -121.16 134.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.493 -0.754 . . . . 0.0 109.862 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.558 ' HB2' HD23 ' B' ' 67' ' ' LEU . 57.5 t80 -140.8 152.5 45.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.469 -0.77 . . . . 0.0 109.941 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.18 27.76 0.35 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.492 -0.755 . . . . 0.0 111.25 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.03 1.64 80.09 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -110.79 137.27 48.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.044 -1.268 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -78.6 135.72 37.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.358 -0.838 . . . . 0.0 109.9 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.923 HD12 ' HB3' ' B' ' 43' ' ' LEU . 51.3 mt -83.83 138.4 33.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.384 -0.822 . . . . 0.0 110.123 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -93.64 131.02 39.34 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 110.422 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 64.3 m-20 -48.34 -27.6 2.65 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.484 -0.76 . . . . 0.0 111.059 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -7.98 86.47 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.2 mmt-85 -99.36 155.87 17.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.007 -1.29 . . . . 0.0 110.442 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.9 p -102.51 163.47 12.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.419 -0.8 . . . . 0.0 110.185 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.556 ' HA ' HD12 ' B' ' 61' ' ' ILE . 98.0 mt -53.49 -44.48 69.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.338 -0.851 . . . . 0.0 110.635 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 60.0 p -56.94 -36.85 70.73 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.333 -0.854 . . . . 0.0 110.986 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.52 -27.68 66.4 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.173 -0.955 . . . . 0.0 110.257 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.665 ' CD2' HD22 ' B' ' 50' ' ' LEU . 58.2 m-85 -100.95 27.74 5.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -0.809 . . . . 0.0 109.803 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 m120 50.74 28.33 3.54 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.544 -0.723 . . . . 0.0 110.673 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.556 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.5 mt -81.56 108.64 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.403 -0.811 . . . . 0.0 109.96 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.65 173.35 6.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.358 -0.839 . . . . 0.0 110.197 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 4.4 pttt -46.6 152.71 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.462 -0.774 . . . . 0.0 110.958 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.5 mt-10 62.67 16.49 8.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.593 -0.692 . . . . 0.0 110.555 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.58 144.97 49.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.259 -0.901 . . . . 0.0 110.117 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.9 m -107.54 107.9 18.95 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.856 . . . . 0.0 109.919 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.558 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.3 mt -102.39 160.62 14.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.116 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -108.83 134.49 51.45 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.293 -0.88 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.8 tp -107.21 133.73 51.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.246 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.443 -0.786 . . . . 0.0 110.293 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 121.21 0.529 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -74.34 -29.07 61.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.19 -0.944 . . . . 0.0 109.086 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.41 96.9 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.54 -0.864 . . . . 0.0 108.928 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 17.1 mt -64.73 -28.85 69.87 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.11 -47.54 28.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.522 -0.736 . . . . 0.0 109.842 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 -53.55 7.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.33 -0.856 . . . . 0.0 110.527 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -51.98 -39.6 59.59 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.177 -0.952 . . . . 0.0 110.714 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 34.3 m -69.2 -43.33 74.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.17 -12.65 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.136 -0.978 . . . . 0.0 110.332 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.53 -41.71 45.74 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.79 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -84.28 -23.02 30.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.416 -0.803 . . . . 0.0 110.249 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 . . . . . 0 N--CA 1.493 1.686 0 O-C-N 121.344 -0.848 . . . . 0.0 110.422 -179.895 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.6 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.354 0.597 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.563 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.5 pt-20 -67.61 -30.99 70.72 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.558 -0.713 . . . . 0.0 109.126 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 65.6 mt-10 -85.31 -40.67 16.3 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.75 -42.16 99.54 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -70.47 -35.62 73.41 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.33 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.23 96.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.484 -0.76 . . . . 0.0 109.624 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -74.05 -51.82 14.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.495 -0.753 . . . . 0.0 110.147 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.92 -37.65 80.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.453 -0.779 . . . . 0.0 110.358 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 tpt -81.57 -20.13 40.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.103 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.088 179.85 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.313 0.578 . . . . 0.0 110.349 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -119.08 137.9 53.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.512 -0.742 . . . . 0.0 109.508 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.461 HD13 HG21 ' B' ' 17' ' ' VAL . 40.1 pt -137.66 157.97 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -0.967 . . . . 0.0 110.626 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' B' ' 14' ' ' THR . 66.3 m-85 -111.91 146.85 37.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.604 -0.685 . . . . 0.0 110.364 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.488 HG11 HD11 ' B' ' 30' ' ' ILE . 66.3 t -127.78 116.55 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 109.598 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.0 136.85 39.29 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.545 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.7 p -96.02 168.3 10.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.444 -0.785 . . . . 0.0 110.063 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt -61.8 -8.84 5.34 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.315 -0.866 . . . . 0.0 111.29 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 47.7 p -95.43 -19.74 19.64 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.079 -1.013 . . . . 0.0 110.597 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.31 6.23 22.24 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 10.5 tttp -84.66 129.7 34.8 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.093 -1.239 . . . . 0.0 109.968 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.6 m -113.21 128.73 56.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.084 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 38.4 mt -109.28 141.19 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.504 -0.748 . . . . 0.0 110.406 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.422 HG23 ' CE1' ' B' ' 4' ' ' PHE . 27.6 m -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.366 -0.834 . . . . 0.0 109.176 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.414 ' CD2' ' CE ' ' B' ' 33' ' ' LYS . 35.0 mt -123.42 154.35 39.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.987 . . . . 0.0 111.137 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -106.32 114.98 29.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.443 -0.786 . . . . 0.0 109.034 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.468 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.4 m -140.01 176.76 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 111.039 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.403 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.1 mp0 -113.19 166.87 10.22 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.88 -25.73 19.62 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 O-C-N 123.493 1.26 . . . . 0.0 110.192 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.82 -1.9 57.03 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.171 -0.956 . . . . 0.0 110.552 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -71.19 140.57 50.54 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.123 -0.986 . . . . 0.0 110.567 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.9 p -83.62 159.2 21.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 110.763 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.629 HG23 HD12 ' B' ' 43' ' ' LEU . 44.1 mm -59.71 -40.57 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.42 -0.8 . . . . 0.0 109.621 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -56.85 -34.58 67.95 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 109.579 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -70.59 -33.6 71.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.514 -0.741 . . . . 0.0 109.329 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 82.0 t -69.91 -40.22 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.415 -0.803 . . . . 0.0 109.186 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -62.86 -41.32 99.32 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.419 -0.801 . . . . 0.0 109.083 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.77 74.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.537 -0.727 . . . . 0.0 109.297 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.414 ' CE ' HG12 ' B' ' 17' ' ' VAL . 6.0 mttm -68.07 -40.5 82.71 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.535 -0.728 . . . . 0.0 109.555 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.75 HD13 HD12 ' B' ' 69' ' ' LEU . 36.8 mt -66.78 -37.34 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.312 -0.868 . . . . 0.0 109.115 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.55 -47.71 84.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.418 -0.801 . . . . 0.0 109.254 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.44 -31.67 67.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.508 -0.745 . . . . 0.0 110.613 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.414 ' CE ' ' CD2' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -83.42 -36.96 23.84 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.293 -0.879 . . . . 0.0 111.262 -179.312 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -108.11 -55.86 2.32 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.106 -0.996 . . . . 0.0 110.55 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 125.88 15.37 2.9 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.474 HG23 ' HD2' ' B' ' 37' ' ' PRO . 90.6 mt -91.25 142.95 27.63 Favored Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.154 -1.203 . . . . 0.0 109.749 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.495 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.6 Cg_endo -68.22 134.79 32.43 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.638 1.336 . . . . 0.0 110.622 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.91 -25.64 81.72 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 O-C-N 123.695 1.366 . . . . 0.0 111.012 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.68 -22.01 64.4 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 109.902 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.495 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.2 mp0 -101.01 -4.25 27.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.454 -0.779 . . . . 0.0 110.513 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -94.26 142.5 27.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.07 130.99 45.59 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.421 -0.799 . . . . 0.0 109.725 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.81 ' HB3' HD12 ' B' ' 50' ' ' LEU . 24.5 mt -104.64 118.72 37.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.244 -0.91 . . . . 0.0 110.448 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.779 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.32 135.37 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.405 -0.81 . . . . 0.0 109.723 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.613 ' HB2' HD23 ' B' ' 67' ' ' LEU . 78.9 t80 -140.72 150.49 43.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.453 -0.779 . . . . 0.0 110.053 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.01 0.4 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.482 -0.761 . . . . 0.0 111.253 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.77 1.97 84.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 136.65 49.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.084 -1.245 . . . . 0.0 110.178 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -78.41 135.17 37.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.831 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.81 HD12 ' HB3' ' B' ' 43' ' ' LEU . 49.1 mt -83.79 140.72 31.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.296 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.58 131.27 39.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.346 -0.846 . . . . 0.0 110.418 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.467 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 76.7 m-20 -48.3 -32.43 7.34 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.438 -0.789 . . . . 0.0 111.051 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.07 -2.69 90.6 Favored Glycine 0 N--CA 1.493 2.492 0 C-N-CA 120.132 -1.032 . . . . 0.0 110.599 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.446 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.8 mmt85 -99.47 153.34 19.1 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.272 . . . . 0.0 110.445 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 82.6 p -102.2 164.63 11.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.451 -0.781 . . . . 0.0 110.174 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.505 HD22 HG21 ' B' ' 61' ' ' ILE . 65.8 mt -53.49 -44.82 69.35 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.28 -0.887 . . . . 0.0 110.743 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 42.3 t -56.62 -35.55 68.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.371 -0.831 . . . . 0.0 111.02 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -59.71 -28.98 67.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.296 -0.878 . . . . 0.0 110.407 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.638 ' CD2' HD22 ' B' ' 50' ' ' LEU . 64.3 m-85 -100.94 24.57 9.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.332 -0.855 . . . . 0.0 110.228 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 50.64 30.76 5.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.489 -0.757 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.505 HG21 HD22 ' B' ' 56' ' ' LEU . 86.1 mt -81.4 114.37 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.409 -0.807 . . . . 0.0 109.926 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -105.77 171.13 7.5 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.372 -0.83 . . . . 0.0 110.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.443 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.1 OUTLIER -46.62 155.11 0.26 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.548 -0.72 . . . . 0.0 111.128 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 63.38 13.11 6.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.702 -0.624 . . . . 0.0 111.003 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.9 141.38 49.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 58.7 m -107.4 115.08 29.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.321 -0.862 . . . . 0.0 109.942 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.613 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.7 mt -102.44 161.13 13.95 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -0.856 . . . . 0.0 110.378 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -108.76 136.79 47.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.312 -0.868 . . . . 0.0 109.806 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.75 HD12 HD13 ' B' ' 30' ' ' ILE . 6.9 tt -107.31 135.96 47.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.176 -0.952 . . . . 0.0 110.466 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.68 ' N ' HD23 ' B' ' 69' ' ' LEU . 47.8 t . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.758 . . . . 0.0 110.048 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 t0 . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.265 0.555 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -74.96 -30.53 61.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.186 -0.947 . . . . 0.0 109.026 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -48.87 79.88 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.564 -0.855 . . . . 0.0 108.819 179.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.12 -29.89 68.92 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 tt -76.23 -35.33 59.06 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.497 0.665 . . . . 0.0 109.563 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 1.3 mttt -81.22 -58.0 3.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.427 -0.795 . . . . 0.0 110.289 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 mtt -51.0 -37.3 44.25 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.363 -0.836 . . . . 0.0 110.642 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.2 m -70.02 -44.47 69.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 110.261 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.5 tp -83.59 -11.67 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.208 -0.933 . . . . 0.0 110.437 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 3.4 m -77.33 -44.68 28.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.207 -0.933 . . . . 0.0 109.711 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.28 -24.29 37.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.523 -0.736 . . . . 0.0 110.019 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 91' ' ' GLU . 69.4 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.374 0.606 . . . . 0.0 110.166 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.599 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.15 -34.64 78.86 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.421 -0.799 . . . . 0.0 109.345 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.415 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.8 mt-10 -85.45 -40.19 16.68 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.6 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.411 ' HB2' ' OG1' ' A' ' 88' ' ' THR . 0.3 OUTLIER -65.11 -42.51 93.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 108.528 179.109 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -70.02 -34.01 72.73 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.599 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.68 -35.69 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.58 -45.52 75.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.585 -0.697 . . . . 0.0 109.551 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -67.08 -32.68 74.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.84 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.57 -34.64 35.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 110.064 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 9.8 mmt -83.89 -26.28 29.53 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.907 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.421 -0.799 . . . . 0.0 110.199 179.947 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.266 0.555 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -97.79 146.46 25.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.498 -0.751 . . . . 0.0 109.93 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.568 HD13 HG21 ' B' ' 17' ' ' VAL . 20.8 pt -137.56 159.03 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.34 -0.85 . . . . 0.0 110.269 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -111.93 142.25 44.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.527 -0.733 . . . . 0.0 110.545 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -127.53 117.91 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.399 -0.813 . . . . 0.0 109.602 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.4 mttm -100.2 130.5 46.34 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.411 -0.806 . . . . 0.0 110.599 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.542 HG22 ' HB3' ' B' ' 69' ' ' LEU . 61.2 p -96.01 175.26 6.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.001 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.433 HD11 HG13 ' B' ' 70' ' ' VAL . 12.7 mt -61.72 -11.31 11.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.251 -0.906 . . . . 0.0 111.039 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 62.9 p -95.72 13.82 25.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.962 -1.086 . . . . 0.0 110.791 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.64 7.84 70.36 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 21.6 tttm -84.83 130.05 34.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.985 -1.303 . . . . 0.0 109.919 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 41.7 m -113.33 125.58 54.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.359 -0.838 . . . . 0.0 110.245 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.28 136.23 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.414 -0.804 . . . . 0.0 110.417 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.4 m -102.19 120.83 41.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.301 -0.875 . . . . 0.0 109.448 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.9 mt -123.64 168.84 12.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.129 -0.982 . . . . 0.0 110.919 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -106.27 113.71 27.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.472 -0.767 . . . . 0.0 109.492 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.568 HG21 HD13 ' B' ' 3' ' ' ILE . 32.3 m -140.68 167.22 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.279 -0.888 . . . . 0.0 110.958 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.55 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -112.69 167.24 9.49 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.535 -0.728 . . . . 0.0 109.06 178.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.94 -26.75 18.3 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.449 1.236 . . . . 0.0 110.39 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.5 -3.15 58.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.183 -0.948 . . . . 0.0 110.523 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.07 141.92 50.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.0 110.47 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.2 p -83.26 158.04 22.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.57 -0.706 . . . . 0.0 110.345 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.716 HG22 ' CE ' ' B' ' 27' ' ' LYS . 44.5 mm -59.71 -36.41 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.349 -0.844 . . . . 0.0 109.494 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.25 -35.38 75.37 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.23 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -31.79 68.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.461 -0.775 . . . . 0.0 109.19 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -70.11 -41.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.493 -0.754 . . . . 0.0 109.089 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.716 ' CE ' HG22 ' B' ' 23' ' ' ILE . 38.1 mttt -62.93 -42.87 99.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.476 -0.765 . . . . 0.0 109.34 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.24 -33.84 74.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.518 -0.739 . . . . 0.0 109.426 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -68.3 -39.29 82.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.506 -0.746 . . . . 0.0 109.558 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.409 HD13 HD22 ' B' ' 69' ' ' LEU . 10.5 mt -67.12 -38.96 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 119.669 -0.812 . . . . 0.0 109.18 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.65 -50.66 72.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.416 -0.802 . . . . 0.0 109.588 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.11 -25.89 61.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.375 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -84.01 -41.94 16.73 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.169 -0.957 . . . . 0.0 110.722 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -107.99 -54.51 2.49 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.16 -0.962 . . . . 0.0 110.502 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.45 21.45 1.81 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.543 HG23 ' HD2' ' B' ' 37' ' ' PRO . 15.2 mt -91.45 145.2 30.89 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.131 -1.217 . . . . 0.0 109.797 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.543 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.8 Cg_endo -67.28 131.51 25.17 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.586 1.308 . . . . 0.0 110.4 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.73 -24.59 79.16 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.676 1.356 . . . . 0.0 110.741 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.74 -25.11 64.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 109.636 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -101.28 9.78 41.37 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.574 -0.703 . . . . 0.0 110.209 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . 0.412 ' HG2' HD11 ' B' ' 69' ' ' LEU . 0.5 OUTLIER -94.25 137.04 33.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.206 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH2' HD11 ' B' ' 44' ' ' ILE . 0.1 OUTLIER -130.04 123.48 30.6 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.351 -0.843 . . . . 0.0 110.1 179.857 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.79 ' C ' HD12 ' B' ' 44' ' ' ILE . 25.0 mt -104.52 115.26 30.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.383 -0.823 . . . . 0.0 110.236 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.79 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.12 137.01 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.515 -0.74 . . . . 0.0 109.727 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -140.65 145.65 36.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.43 -0.794 . . . . 0.0 109.82 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.41 29.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.504 -0.747 . . . . 0.0 111.062 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.3 6.43 87.8 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -111.09 131.6 54.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.051 -1.264 . . . . 0.0 110.238 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -78.59 131.68 36.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.257 -0.902 . . . . 0.0 109.615 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.641 HD22 ' CG ' ' B' ' 59' ' ' TYR . 26.1 mt -83.95 139.01 32.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.904 . . . . 0.0 110.351 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.71 132.43 38.08 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.319 -0.863 . . . . 0.0 110.775 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.468 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 7.8 m-20 -48.42 -28.38 3.22 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.519 -0.738 . . . . 0.0 111.104 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.95 -6.69 88.12 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.59 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -99.38 156.27 17.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.072 -1.252 . . . . 0.0 110.45 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.8 p -102.12 162.24 13.07 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.822 . . . . 0.0 110.249 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.634 ' HA ' HD12 ' B' ' 61' ' ' ILE . 86.8 mt -53.42 -44.72 69.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.315 -0.865 . . . . 0.0 110.667 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.9 t -56.65 -34.5 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.322 -0.861 . . . . 0.0 110.991 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -59.63 -28.06 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.228 -0.92 . . . . 0.0 110.403 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.641 ' CG ' HD22 ' B' ' 50' ' ' LEU . 73.9 m-85 -101.18 27.42 6.15 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.382 -0.824 . . . . 0.0 109.958 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 m120 50.94 31.85 6.72 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.46 -0.775 . . . . 0.0 110.757 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.634 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.6 mt -81.7 113.8 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.049 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -105.72 167.93 9.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.367 -0.833 . . . . 0.0 110.122 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 12.2 pttp -46.46 153.09 0.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.496 -0.752 . . . . 0.0 110.918 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.4 OUTLIER 62.48 16.8 8.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.595 -0.691 . . . . 0.0 110.511 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.51 146.18 48.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 110.302 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -107.67 109.17 20.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.391 -0.818 . . . . 0.0 109.957 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.507 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.56 162.78 12.65 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.293 -0.88 . . . . 0.0 110.075 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -108.75 131.2 55.17 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.215 -0.928 . . . . 0.0 109.906 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.542 ' HB3' HG22 ' B' ' 7' ' ' THR . 57.6 tp -107.17 128.09 54.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 0.0 110.385 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.433 HG13 HD11 ' B' ' 8' ' ' LEU . 47.2 t . . . . . 0 N--CA 1.493 1.677 0 O-C-N 121.428 -0.795 . . . . 0.0 110.007 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 t0 . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.291 0.567 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -76.11 -29.77 58.0 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.296 -0.877 . . . . 0.0 109.131 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.47 96.8 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.796 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -29.2 70.26 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -40.21 55.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.466 -0.771 . . . . 0.0 109.87 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HA ' HG22 ' A' ' 71' ' ' ILE . 10.8 mmtp -81.79 -55.28 4.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.387 -0.821 . . . . 0.0 110.516 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 tpp -52.37 -42.42 63.95 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.152 -0.968 . . . . 0.0 110.604 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 84.7 m -68.02 -42.86 80.01 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.311 -0.868 . . . . 0.0 110.559 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.415 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.3 tp -82.5 -12.99 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.231 -0.918 . . . . 0.0 110.413 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.9 m -76.08 -39.43 55.37 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.338 -0.851 . . . . 0.0 109.749 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -84.35 -27.09 27.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.416 -0.802 . . . . 0.0 110.079 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.941 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.6 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.282 0.563 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.575 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.3 pt-20 -71.52 -32.36 68.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.457 -0.777 . . . . 0.0 109.207 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 26.7 mt-10 -85.24 -38.18 19.21 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.272 179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -43.21 89.19 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -68.07 -35.23 77.86 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.575 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.81 -37.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.46 -33.35 74.66 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.496 -0.752 . . . . 0.0 109.823 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -75.78 -31.66 59.58 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.36 -32.44 29.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.457 -0.777 . . . . 0.0 110.167 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.54 -29.77 27.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.36 -0.837 . . . . 0.0 109.689 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.373 -0.829 . . . . 0.0 109.915 179.854 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.435 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.4 ttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.253 0.549 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 140.68 29.48 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.33 -0.856 . . . . 0.0 109.725 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.41 158.06 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.235 -0.915 . . . . 0.0 110.32 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.81 143.85 42.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.71 -0.619 . . . . 0.0 110.681 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 64.1 t -127.99 124.58 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 109.517 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 13.1 mttt -99.88 134.11 43.27 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.423 -0.798 . . . . 0.0 110.291 -179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 40.3 p -95.47 172.89 7.8 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.331 -0.856 . . . . 0.0 110.302 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.475 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.26 -13.54 19.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.486 -0.759 . . . . 0.0 111.034 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.5 p -95.72 -5.77 41.36 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.026 -1.046 . . . . 0.0 110.997 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.99 9.43 57.21 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.1 OUTLIER -84.62 136.53 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.259 . . . . 0.0 109.779 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 31.0 m -113.07 127.32 56.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.229 -0.919 . . . . 0.0 110.373 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.29 137.27 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 23.3 m -102.09 120.68 40.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.3 mt -123.48 158.59 30.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.095 -1.003 . . . . 0.0 110.918 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -106.29 113.8 27.54 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 109.385 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.62 HG12 ' HD3' ' B' ' 29' ' ' LYS . 34.0 m -140.29 177.4 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.266 -0.896 . . . . 0.0 110.938 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.52 ' O ' HD12 ' B' ' 56' ' ' LEU . 18.3 mt-10 -113.03 164.61 15.07 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.89 -27.27 17.87 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.523 1.275 . . . . 0.0 110.282 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.63 -1.34 55.9 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.885 . . . . 0.0 110.735 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.99 143.87 50.67 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.073 -1.017 . . . . 0.0 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 81.1 p -83.4 159.15 21.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.491 -0.756 . . . . 0.0 110.606 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 44.7 mm -59.62 -37.45 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.381 -0.824 . . . . 0.0 109.461 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -60.22 -34.67 73.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.422 -0.799 . . . . 0.0 109.358 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.47 -33.77 71.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.0 109.264 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.1 t -70.04 -40.06 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.454 -0.779 . . . . 0.0 109.26 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -62.9 -42.62 99.85 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.462 -0.774 . . . . 0.0 109.206 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.56 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.481 -0.762 . . . . 0.0 109.368 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.62 ' HD3' HG12 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -68.15 -39.8 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.567 -0.708 . . . . 0.0 109.535 179.408 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.553 HD13 HD22 ' B' ' 69' ' ' LEU . 17.8 mt -67.01 -37.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.96 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 50.0 tt0 -60.77 -50.57 72.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.377 -0.827 . . . . 0.0 109.374 178.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -58.07 -27.72 63.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 110.517 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -83.93 -39.04 20.29 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.307 -0.871 . . . . 0.0 110.778 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -108.07 -56.85 2.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 127.23 19.19 1.96 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.079 -1.209 . . . . 0.0 110.079 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.518 HG23 ' HD2' ' B' ' 37' ' ' PRO . 25.2 mt -91.43 144.03 29.06 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.092 -1.24 . . . . 0.0 109.93 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.518 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.6 Cg_endo -68.28 132.3 25.5 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.714 1.376 . . . . 0.0 110.459 179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.67 -25.12 80.28 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.736 1.387 . . . . 0.0 110.816 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -26.15 64.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.418 -0.801 . . . . 0.0 109.84 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.439 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.6 mm100 -101.24 2.5 39.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.446 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -94.21 139.65 30.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.09 129.05 43.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.38 -0.825 . . . . 0.0 110.15 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.907 ' HB3' HD12 ' B' ' 50' ' ' LEU . 17.4 mt -104.71 118.57 36.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.797 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.09 135.09 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.436 -0.79 . . . . 0.0 109.992 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -140.73 149.5 42.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.606 -0.684 . . . . 0.0 109.543 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 28.46 0.52 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.423 -0.798 . . . . 0.0 111.088 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.36 2.1 78.14 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -111.04 136.79 49.52 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.093 -1.239 . . . . 0.0 110.215 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -78.4 138.99 38.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.227 -0.921 . . . . 0.0 109.824 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.907 HD12 ' HB3' ' B' ' 43' ' ' LEU . 47.9 mt -83.68 140.8 31.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.374 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.56 128.15 39.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.409 -0.807 . . . . 0.0 110.429 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 75.4 m-20 -48.35 -29.88 4.39 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.472 -0.767 . . . . 0.0 111.127 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.92 -5.19 89.58 Favored Glycine 0 N--CA 1.493 2.498 0 C-N-CA 120.121 -1.038 . . . . 0.0 110.622 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt-85 -99.34 155.97 17.24 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.983 -1.304 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.7 p -102.46 165.4 11.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.393 -0.817 . . . . 0.0 110.232 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.52 HD12 ' O ' ' B' ' 18' ' ' GLU . 64.9 mt -53.78 -47.62 70.57 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 29.1 t -56.75 -35.95 69.22 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.333 -0.854 . . . . 0.0 111.18 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -59.47 -27.38 66.06 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.107 -0.995 . . . . 0.0 110.236 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.473 ' CD2' HD22 ' B' ' 50' ' ' LEU . 34.2 m-85 -101.37 27.96 5.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.394 -0.816 . . . . 0.0 109.919 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 50.72 26.51 2.56 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.513 -0.742 . . . . 0.0 110.829 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.52 HD13 HD21 ' B' ' 67' ' ' LEU . 96.4 mt -81.53 109.56 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.274 -0.891 . . . . 0.0 109.906 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -105.68 173.38 6.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.379 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.7 151.72 0.56 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 111.088 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 35.0 mt-10 63.0 16.33 9.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.768 -0.582 . . . . 0.0 110.616 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.4 144.61 49.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 12.6 m -107.4 108.46 19.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 109.821 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.52 HD21 HD13 ' B' ' 61' ' ' ILE . 1.9 mt -102.31 160.29 14.66 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.318 -0.864 . . . . 0.0 110.041 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -108.95 132.89 53.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.278 -0.889 . . . . 0.0 110.151 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.553 HD22 HD13 ' B' ' 30' ' ' ILE . 61.8 tp -107.21 130.94 54.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.861 . . . . 0.0 109.95 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 16.6 t . . . . . 0 N--CA 1.492 1.655 0 O-C-N 121.452 -0.78 . . . . 0.0 110.155 -179.935 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.238 0.542 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -76.23 -28.24 57.1 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.205 -0.934 . . . . 0.0 109.221 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.7 99.62 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.584 -0.846 . . . . 0.0 108.882 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.85 -29.66 69.63 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -76.58 -37.53 56.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.578 -0.701 . . . . 0.0 109.871 179.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.457 ' HA ' HG22 ' A' ' 71' ' ' ILE . 21.5 mmtm -83.87 -55.24 4.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 110.361 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.9 tpt -52.86 -42.75 65.52 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.7 m -69.96 -41.85 73.95 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.457 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.8 tp -83.77 -12.08 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 110.59 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 68' ' ' LYS . 83.5 p -78.78 -45.42 21.06 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.175 -0.953 . . . . 0.0 109.801 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -82.97 -18.78 38.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.499 -0.751 . . . . 0.0 110.267 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.184 -0.947 . . . . 0.0 110.677 -179.742 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.496 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.6 p . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.382 0.611 . . . . 0.0 110.433 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 pt-20 -70.78 -30.04 66.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.514 -0.741 . . . . 0.0 109.149 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.453 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 6.9 mt-10 -83.44 -38.37 21.97 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.496 ' HB2' ' N ' ' A' ' 88' ' ' THR . 69.5 mm-40 -65.37 -43.69 89.98 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -66.95 -35.27 79.6 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.99 -36.95 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.77 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.96 81.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.79 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.18 -54.52 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.072 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.3 -34.15 74.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.5 ttp -80.91 -25.28 37.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.799 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.427 -0.796 . . . . 0.0 109.997 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.442 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.3 ttp . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.21 0.528 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.69 140.55 29.41 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.405 -0.81 . . . . 0.0 109.708 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.654 HD13 HG21 ' B' ' 17' ' ' VAL . 42.6 pt -137.33 158.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.19 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -111.67 145.88 38.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.557 -0.714 . . . . 0.0 110.427 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' B' ' 12' ' ' THR . 61.7 t -127.89 122.55 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.452 -0.78 . . . . 0.0 109.95 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.473 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.38 128.51 46.43 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.515 -0.741 . . . . 0.0 110.257 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.505 HG22 HD23 ' B' ' 69' ' ' LEU . 66.8 p -95.74 177.51 5.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.371 -0.83 . . . . 0.0 110.473 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.471 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.12 -16.98 50.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.44 -0.788 . . . . 0.0 110.841 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.6 p -96.04 21.71 8.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.065 -1.022 . . . . 0.0 110.661 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.6 15.96 58.13 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.9 ttpm? -84.73 131.58 34.55 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.128 -1.219 . . . . 0.0 109.821 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 22.5 m -112.84 125.21 54.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.402 HD13 HG21 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -109.65 141.52 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.399 -0.813 . . . . 0.0 110.258 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.613 ' C ' HD12 ' B' ' 15' ' ' LEU . 7.4 m -101.94 120.06 39.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.295 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.613 HD12 ' C ' ' B' ' 14' ' ' THR . 7.2 mp -123.24 159.64 28.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.211 -0.931 . . . . 0.0 110.978 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.62 114.96 29.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 109.317 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.654 HG21 HD13 ' B' ' 3' ' ' ILE . 32.7 m -140.15 172.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.241 -0.912 . . . . 0.0 110.883 -179.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.576 ' O ' HD12 ' B' ' 56' ' ' LEU . 3.4 mp0 -112.86 165.1 13.82 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.54 -28.29 17.79 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.587 1.309 . . . . 0.0 110.384 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -84.66 -2.14 57.09 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.199 -0.938 . . . . 0.0 110.649 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.14 141.67 50.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.22 -0.925 . . . . 0.0 110.538 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.0 p -83.36 159.77 21.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 110.378 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.4 mm -59.93 -35.46 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.377 -0.827 . . . . 0.0 109.773 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -60.83 -38.04 84.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.828 . . . . 0.0 109.587 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -69.95 -31.51 69.29 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 109.195 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 22' ' ' THR . 67.2 t -70.1 -39.8 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.0 109.086 179.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.05 -42.16 99.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.565 -0.709 . . . . 0.0 109.144 179.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.27 -34.74 75.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.5 -0.75 . . . . 0.0 109.243 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.523 ' HD3' HG12 ' B' ' 17' ' ' VAL . 17.6 mttp -68.13 -35.48 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.328 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.2 mt -67.71 -42.04 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.447 -0.783 . . . . 0.0 109.279 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 11.4 tt0 -60.11 -49.58 77.09 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.805 . . . . 0.0 109.445 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.35 -25.81 62.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.379 -0.826 . . . . 0.0 110.393 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -84.04 -43.97 14.59 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.262 -0.898 . . . . 0.0 110.873 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -107.99 -50.29 3.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.219 -0.926 . . . . 0.0 110.631 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.55 18.23 3.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 110.074 -1.211 . . . . 0.0 110.074 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.545 HG23 ' HD2' ' B' ' 37' ' ' PRO . 91.0 mt -91.28 145.32 31.26 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.133 -1.216 . . . . 0.0 109.735 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.545 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.2 Cg_endo -67.75 133.93 31.02 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.579 1.304 . . . . 0.0 110.505 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.71 -25.94 81.97 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.781 1.411 . . . . 0.0 110.746 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.7 -21.98 64.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.785 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.424 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.2 mt-30 -101.18 0.59 37.86 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.463 -0.773 . . . . 0.0 110.337 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -94.25 138.51 32.18 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.892 . . . . 0.0 110.472 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.501 ' C ' HD22 ' B' ' 43' ' ' LEU . 1.2 mtt85 -130.06 128.53 42.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.715 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.776 ' C ' HD12 ' B' ' 44' ' ' ILE . 4.5 mm? -104.44 114.94 29.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.367 -0.833 . . . . 0.0 110.37 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.776 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.23 134.07 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.561 -0.712 . . . . 0.0 109.811 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -140.92 148.6 40.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.421 -0.799 . . . . 0.0 109.95 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.49 28.57 0.51 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 111.134 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.58 2.16 84.38 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.03 130.99 55.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.117 -1.225 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -78.52 136.68 37.62 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.318 -0.864 . . . . 0.0 109.814 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.753 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.4 mt -83.99 141.09 31.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.302 -0.874 . . . . 0.0 110.303 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -93.79 133.12 37.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.357 -0.84 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.515 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 15.8 m-20 -48.17 -30.62 4.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.514 -0.741 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -5.51 89.21 Favored Glycine 0 N--CA 1.494 2.548 0 C-N-CA 120.159 -1.019 . . . . 0.0 110.732 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.446 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.1 mmt-85 -99.28 155.12 17.67 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.053 -1.263 . . . . 0.0 110.477 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.5 p -102.16 163.97 11.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.46 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.576 HD12 ' O ' ' B' ' 18' ' ' GLU . 83.5 mt -53.69 -45.44 70.37 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.352 -0.843 . . . . 0.0 110.877 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 18.2 t -56.58 -34.2 66.93 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.408 -0.807 . . . . 0.0 110.956 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -59.7 -27.79 66.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.753 ' CD2' HD22 ' B' ' 50' ' ' LEU . 76.7 m-85 -101.19 26.0 7.58 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -0.844 . . . . 0.0 110.166 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 50.68 30.4 4.9 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.436 -0.79 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.502 HD13 HD21 ' B' ' 67' ' ' LEU . 94.7 mt -81.41 113.64 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.215 -0.928 . . . . 0.0 109.84 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -105.68 170.44 7.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.366 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.1 pttt -46.71 152.46 0.48 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.5 -0.75 . . . . 0.0 111.11 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.4 mm-40 63.31 15.03 8.34 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.688 -0.632 . . . . 0.0 110.696 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.74 144.47 49.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.147 -0.97 . . . . 0.0 110.073 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -107.44 113.18 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.81 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.502 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.39 162.45 12.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.4 -0.813 . . . . 0.0 110.125 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -108.74 132.59 53.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 109.665 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.505 HD23 HG22 ' B' ' 7' ' ' THR . 42.7 tp -106.89 131.25 54.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 110.314 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 45.6 t . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.417 -0.802 . . . . 0.0 110.289 -179.902 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.1 t0 . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 121.257 0.551 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -78.14 -32.9 50.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.169 -0.957 . . . . 0.0 109.471 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.49 -37.06 82.28 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.402 -0.919 . . . . 0.0 108.736 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.456 ' O ' HG23 ' A' ' 70' ' ' THR . 5.9 mt -69.55 -31.44 69.63 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.14 -43.89 55.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.583 -0.698 . . . . 0.0 109.576 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -75.9 -53.42 8.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.497 -0.752 . . . . 0.0 110.094 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.0 ttt -49.36 -37.34 24.47 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.256 -0.903 . . . . 0.0 110.743 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.456 HG23 ' O ' ' A' ' 66' ' ' LEU . 15.5 p -71.09 -39.59 72.05 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.334 -0.854 . . . . 0.0 110.526 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.411 HG22 ' O ' ' A' ' 68' ' ' LYS . 5.1 tp -83.93 -16.82 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.256 -0.903 . . . . 0.0 110.289 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.87 -41.19 60.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.946 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -86.63 -19.24 29.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.46 -0.775 . . . . 0.0 110.28 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.28 -0.887 . . . . 0.0 110.338 179.946 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.481 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 81.4 p . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 121.321 0.581 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.556 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.4 mt-10 -75.82 -29.26 58.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.447 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 2.6 mp0 -85.48 -36.53 20.5 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.481 ' HB2' ' N ' ' A' ' 88' ' ' THR . 63.1 mm-40 -66.26 -44.35 83.87 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.556 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -70.64 -33.69 54.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.737 -0.602 . . . . 0.0 109.401 178.92 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.19 91.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.432 -0.793 . . . . 0.0 110.051 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -37.22 21.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 109.967 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.17 -37.88 81.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.271 -0.893 . . . . 0.0 110.185 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.2 ttt -81.51 -22.56 37.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.948 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 110.094 -179.952 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 44.6 ttp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -92.65 139.42 30.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.359 -0.838 . . . . 0.0 109.79 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.6 158.18 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 110.348 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -112.0 144.36 41.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.567 -0.708 . . . . 0.0 110.779 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.79 118.23 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.488 -0.757 . . . . 0.0 109.588 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 34.2 mttt -100.25 129.9 46.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.422 -0.798 . . . . 0.0 110.578 -179.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.54 HG22 ' HB3' ' B' ' 69' ' ' LEU . 40.0 p -96.13 174.98 6.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.377 -0.827 . . . . 0.0 110.136 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 37.0 mt -61.47 -13.6 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.335 -0.853 . . . . 0.0 111.056 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.2 p -95.72 18.13 13.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.099 -1.0 . . . . 0.0 110.698 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.28 11.62 61.94 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.0 tttp -84.96 127.76 34.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.055 -1.262 . . . . 0.0 109.895 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.9 m -112.94 125.15 54.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.264 -0.898 . . . . 0.0 110.272 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 31.6 mt -109.51 138.65 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.464 -0.773 . . . . 0.0 110.492 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.4 m -102.59 121.21 41.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.774 . . . . 0.0 109.452 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.53 HD23 ' HE3' ' B' ' 33' ' ' LYS . 49.1 mt -123.75 161.41 25.23 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.127 -0.983 . . . . 0.0 111.163 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -106.31 114.59 28.8 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.536 -0.727 . . . . 0.0 109.27 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.532 HG12 ' CE ' ' B' ' 29' ' ' LYS . 33.9 m -140.2 175.52 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.282 -0.886 . . . . 0.0 110.85 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.63 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.5 mp0 -113.36 165.88 12.38 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.91 -27.37 17.7 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 O-C-N 123.453 1.238 . . . . 0.0 110.234 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.68 -1.57 56.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.144 -0.972 . . . . 0.0 110.518 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -71.26 143.22 50.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.213 -0.929 . . . . 0.0 110.477 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 75.9 p -83.24 158.24 22.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.597 -0.689 . . . . 0.0 110.396 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.572 HG23 HD12 ' B' ' 43' ' ' LEU . 42.8 mm -59.71 -37.58 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 109.413 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -60.0 -34.59 73.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.427 -0.796 . . . . 0.0 109.148 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -70.33 -31.86 69.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.546 -0.721 . . . . 0.0 109.198 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.93 -39.77 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -62.85 -41.73 99.47 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.43 -33.2 73.31 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.551 -0.718 . . . . 0.0 109.229 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.532 ' CE ' HG12 ' B' ' 17' ' ' VAL . 7.2 mttp -68.43 -38.56 81.32 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.991 -0.684 . . . . 0.0 109.504 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.459 HD13 HD22 ' B' ' 69' ' ' LEU . 12.5 mt -67.41 -40.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.313 -0.867 . . . . 0.0 109.33 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -60.44 -49.36 77.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.299 -0.876 . . . . 0.0 109.574 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -58.05 -28.2 64.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.504 -0.747 . . . . 0.0 110.46 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.53 ' HE3' HD23 ' B' ' 15' ' ' LEU . 12.8 mmtt -83.61 -43.11 15.99 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.387 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -108.13 -116.98 0.27 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.36 -0.838 . . . . 0.0 109.842 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.67 22.1 0.21 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 83.0 mt -91.94 141.44 25.39 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.149 -1.206 . . . . 0.0 109.982 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.571 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.5 Cg_endo -71.71 139.16 33.27 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.637 1.336 . . . . 0.0 110.217 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.62 -27.16 84.34 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 O-C-N 123.675 1.355 . . . . 0.0 111.075 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -68.77 -23.6 64.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.287 -0.883 . . . . 0.0 109.904 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.571 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 5.8 mp0 -100.98 2.79 40.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.418 -0.801 . . . . 0.0 110.661 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -94.17 136.51 34.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.178 -0.951 . . . . 0.0 110.5 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -130.21 128.42 41.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.476 -0.765 . . . . 0.0 109.789 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.909 ' HB3' HD12 ' B' ' 50' ' ' LEU . 19.2 mt -104.54 118.51 36.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.303 -0.873 . . . . 0.0 110.336 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.23 133.67 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.533 -0.729 . . . . 0.0 109.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.5 ' HB2' HD23 ' B' ' 67' ' ' LEU . 31.0 t80 -140.77 152.44 45.23 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.367 -0.833 . . . . 0.0 109.995 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.417 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.14 27.43 0.31 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.459 -0.776 . . . . 0.0 111.118 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.73 1.16 83.07 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -110.95 138.05 47.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -1.21 . . . . 0.0 110.226 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -78.7 136.01 37.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.333 -0.854 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.909 HD12 ' HB3' ' B' ' 43' ' ' LEU . 57.5 mt -83.63 139.55 32.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.188 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 129.06 40.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.396 -0.815 . . . . 0.0 110.404 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.478 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 11.8 m-20 -48.4 -27.3 2.53 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.418 -0.801 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.61 86.97 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.118 -1.039 . . . . 0.0 110.564 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.438 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 21.0 mmt180 -99.23 155.8 17.3 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.988 -1.301 . . . . 0.0 110.428 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.3 p -102.2 165.22 11.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.385 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.63 HD12 ' O ' ' B' ' 18' ' ' GLU . 87.9 mt -53.59 -44.6 69.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.358 -0.839 . . . . 0.0 110.673 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.2 t -56.61 -36.49 69.48 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.451 -0.781 . . . . 0.0 110.865 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.89 -27.71 66.94 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.236 -0.915 . . . . 0.0 110.418 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.606 ' CG ' HD22 ' B' ' 50' ' ' LEU . 71.2 m-85 -101.12 25.28 8.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.352 -0.842 . . . . 0.0 110.209 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 30.1 m120 50.66 30.94 5.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.378 -0.826 . . . . 0.0 110.554 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.621 HD12 ' HA ' ' B' ' 56' ' ' LEU . 89.1 mt -81.38 112.54 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.856 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -105.65 169.35 8.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.366 -0.834 . . . . 0.0 110.191 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 7.5 pttm -46.51 152.7 0.43 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.582 -0.699 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 61.1 mm-40 63.08 15.42 8.47 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.768 -0.583 . . . . 0.0 110.719 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.92 49.84 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.191 -0.943 . . . . 0.0 110.078 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 17.7 m -107.62 110.74 22.69 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.989 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.5 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.2 mt -102.46 164.29 11.75 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.355 -0.84 . . . . 0.0 110.169 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 67.1 m80 -108.93 132.76 53.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' B' ' 7' ' ' THR . 57.0 tp -107.3 130.34 54.78 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.23 -0.919 . . . . 0.0 110.478 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 N--CA 1.492 1.672 0 O-C-N 121.403 -0.811 . . . . 0.0 110.01 179.866 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.7 t70 . . . . . 0 N--CA 1.494 1.754 0 CA-C-O 121.203 0.525 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.0 -29.04 60.76 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.193 -0.942 . . . . 0.0 109.145 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.55 96.43 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.597 -0.841 . . . . 0.0 108.855 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tp -64.78 -28.52 69.63 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 tt -74.69 -47.71 30.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.52 -0.737 . . . . 0.0 109.875 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.01 -52.61 8.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.484 -0.76 . . . . 0.0 110.617 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.4 ttp -51.89 -38.86 57.76 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.226 -0.921 . . . . 0.0 110.65 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.5 m -70.31 -42.28 72.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.325 -0.86 . . . . 0.0 110.357 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.4 HD12 ' HA ' ' A' ' 71' ' ' ILE . 4.7 tp -81.53 -15.62 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.191 -0.943 . . . . 0.0 110.081 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -74.16 -39.89 62.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.394 -0.816 . . . . 0.0 109.672 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -80.88 -29.3 35.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.476 -0.765 . . . . 0.0 109.862 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.41 -0.806 . . . . 0.0 110.105 179.823 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.1 p . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.262 0.553 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.6 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.9 pt-20 -65.06 -32.77 74.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.548 -0.72 . . . . 0.0 109.356 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.43 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.5 mt-10 -85.32 -41.2 15.72 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 120.074 -0.65 . . . . 0.0 109.362 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -63.95 -39.89 95.18 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -71.8 -35.13 69.89 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.6 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -63.19 -41.1 91.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.846 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.411 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -62.26 -31.11 71.64 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -82.97 -36.06 25.42 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.737 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.98 -35.55 66.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.445 -0.784 . . . . 0.0 110.037 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.1 ppp? -79.22 -25.65 42.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.457 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 . . . . . 0 N--CA 1.488 1.43 0 O-C-N 121.451 -0.781 . . . . 0.0 109.849 179.821 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.334 0.588 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -97.47 146.38 25.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -0.783 . . . . 0.0 110.035 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.572 HD13 HG21 ' B' ' 17' ' ' VAL . 24.1 pt -137.53 157.4 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 110.025 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -111.68 143.59 42.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.686 -0.634 . . . . 0.0 110.638 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 12' ' ' THR . 59.0 t -127.78 118.56 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.42 -0.8 . . . . 0.0 109.405 179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.3 mtpt -100.1 138.05 37.71 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.365 -0.835 . . . . 0.0 110.574 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 42.5 p -96.14 170.13 9.48 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.455 -0.778 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.62 HD11 HG13 ' B' ' 70' ' ' VAL . 17.5 mt -61.7 -10.58 8.96 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.407 -0.808 . . . . 0.0 111.181 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.3 p -95.29 -24.38 16.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.961 -1.087 . . . . 0.0 110.507 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.6 7.31 10.9 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.4 tttp -84.64 128.56 34.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.057 -1.26 . . . . 0.0 109.943 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 27.4 m -113.16 125.29 54.18 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 110.198 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.19 135.67 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.41 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 7.1 m -102.43 119.26 38.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 109.532 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.3 mt -123.58 166.97 14.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.107 -0.996 . . . . 0.0 110.859 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -106.5 114.63 28.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 109.382 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.572 HG21 HD13 ' B' ' 3' ' ' ILE . 33.0 m -140.39 169.53 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.991 -179.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.537 ' O ' HD12 ' B' ' 56' ' ' LEU . 27.4 mt-10 -112.46 166.18 11.52 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.512 -0.742 . . . . 0.0 109.101 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.48 -26.44 20.16 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.499 1.263 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.63 -2.4 57.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.133 -0.979 . . . . 0.0 110.474 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -71.28 141.35 50.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.157 -0.964 . . . . 0.0 110.396 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 44.0 p -83.43 157.51 22.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.542 -0.724 . . . . 0.0 110.385 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.574 HG23 HD12 ' B' ' 43' ' ' LEU . 39.9 mm -59.55 -31.18 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.259 -0.901 . . . . 0.0 109.529 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.93 -36.91 85.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.486 -0.759 . . . . 0.0 109.377 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -32.89 70.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.486 -0.759 . . . . 0.0 109.206 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.02 -39.86 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.434 -0.791 . . . . 0.0 109.126 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.456 ' HE2' HG22 ' B' ' 23' ' ' ILE . 6.4 mttm -63.02 -42.39 99.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.49 -0.756 . . . . 0.0 109.147 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.01 74.72 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.538 -0.726 . . . . 0.0 109.392 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -68.31 -39.74 81.93 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.459 -0.776 . . . . 0.0 109.616 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.473 HD13 HD22 ' B' ' 69' ' ' LEU . 13.3 mt -67.2 -38.8 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.373 -0.829 . . . . 0.0 109.248 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -52.41 65.24 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.473 -0.767 . . . . 0.0 109.768 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -58.09 -26.69 62.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.412 -0.805 . . . . 0.0 110.575 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.1 mmtm -83.97 -39.01 20.25 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.25 -0.906 . . . . 0.0 110.986 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -107.97 -54.89 2.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.208 -0.933 . . . . 0.0 110.501 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.75 14.28 2.34 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.492 HG23 ' HD2' ' B' ' 37' ' ' PRO . 23.0 mt -91.28 143.35 28.17 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.007 -1.29 . . . . 0.0 109.756 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.3 Cg_endo -69.88 137.06 34.23 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 123.665 1.35 . . . . 0.0 110.501 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.77 -27.04 84.16 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 O-C-N 123.728 1.383 . . . . 0.0 111.197 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.65 -22.62 64.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.262 -0.899 . . . . 0.0 109.88 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.531 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.5 mp0 -101.12 -1.87 32.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.417 -0.802 . . . . 0.0 110.518 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.01 140.95 29.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.181 -0.949 . . . . 0.0 110.492 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.13 127.62 40.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 109.853 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.773 ' C ' HD12 ' B' ' 44' ' ' ILE . 19.2 mt -104.58 118.17 35.92 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.93 . . . . 0.0 110.223 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.773 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.2 137.95 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.493 -0.755 . . . . 0.0 109.821 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.79 147.83 39.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.438 -0.789 . . . . 0.0 109.795 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 29.05 0.54 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.407 -0.808 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.13 6.01 87.41 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 110.621 -0.991 . . . . 0.0 110.621 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mtmm -110.96 134.44 52.58 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.054 -1.262 . . . . 0.0 110.293 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.38 131.07 36.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.866 . . . . 0.0 109.542 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.708 HD12 ' HB3' ' B' ' 43' ' ' LEU . 38.7 mt -83.65 135.55 34.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -93.5 132.88 37.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.396 -0.815 . . . . 0.0 110.578 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.452 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.2 m-20 -48.38 -26.29 2.0 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.588 -0.695 . . . . 0.0 111.165 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.8 -7.81 86.8 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.5 mmt-85 -99.54 154.23 18.41 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.266 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 23.3 p -102.4 164.18 11.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.374 -0.828 . . . . 0.0 110.174 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' B' ' 61' ' ' ILE . 92.8 mt -53.53 -43.35 68.29 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.266 -0.896 . . . . 0.0 110.671 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 13.2 t -56.81 -36.24 69.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.402 -0.811 . . . . 0.0 110.971 -179.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.62 -27.75 66.59 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.231 -0.918 . . . . 0.0 110.398 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.599 ' CG ' HD22 ' B' ' 50' ' ' LEU . 80.3 m-85 -100.92 25.83 7.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.228 -0.92 . . . . 0.0 110.068 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 50.65 30.31 4.8 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.589 HD13 HD21 ' B' ' 67' ' ' LEU . 90.9 mt -81.35 113.07 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.402 -0.811 . . . . 0.0 109.934 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -105.58 171.82 7.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.452 -0.78 . . . . 0.0 110.179 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 pttp -46.51 152.39 0.46 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.487 -0.758 . . . . 0.0 111.0 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 5.1 mt-10 62.74 16.35 8.9 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.693 -0.63 . . . . 0.0 110.639 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.05 49.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.041 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.3 m -107.62 111.1 23.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.344 -0.848 . . . . 0.0 109.977 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.589 HD21 HD13 ' B' ' 61' ' ' ILE . 1.3 mt -102.55 164.92 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.325 -0.86 . . . . 0.0 110.13 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -108.79 132.37 54.05 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.301 -0.874 . . . . 0.0 110.186 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.473 HD22 HD13 ' B' ' 30' ' ' ILE . 59.6 tp -107.3 131.4 54.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.346 -0.846 . . . . 0.0 110.255 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.62 HG13 HD11 ' B' ' 8' ' ' LEU . 39.5 t . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 121.168 0.508 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.84 -32.08 57.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.252 -0.905 . . . . 0.0 109.29 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.28 82.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.49 -0.884 . . . . 0.0 108.784 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -70.51 -29.43 65.93 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.452 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.0 tt -76.88 -40.89 45.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.55 -0.719 . . . . 0.0 109.874 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HA ' HG22 ' A' ' 71' ' ' ILE . 4.0 tptt -82.97 -50.17 8.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.403 -0.811 . . . . 0.0 110.529 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.5 tpt -57.46 -40.59 78.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.6 m -69.72 -40.57 76.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.271 -0.893 . . . . 0.0 110.414 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.3 tp -83.66 -16.5 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 O-C-N 121.215 -0.928 . . . . 0.0 110.288 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -73.91 -42.03 61.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.252 -0.905 . . . . 0.0 109.782 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -81.51 -26.12 35.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.44 -0.787 . . . . 0.0 110.026 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.444 -0.785 . . . . 0.0 110.237 179.887 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.332 0.586 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 pt-20 -66.1 -32.42 73.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.617 -0.677 . . . . 0.0 109.317 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.441 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.2 mp0 -85.3 -40.36 16.65 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.26 -41.43 99.04 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -71.14 -35.4 71.68 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.568 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.9 -38.7 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -34.42 78.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.455 -0.778 . . . . 0.0 109.736 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -80.0 -44.23 20.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.417 -0.802 . . . . 0.0 110.16 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.32 -31.7 67.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.294 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 56.2 tpp -82.54 -20.81 35.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.365 -0.835 . . . . 0.0 109.981 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 110.096 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.438 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.153 0.501 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -87.65 140.42 29.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.371 -0.831 . . . . 0.0 109.882 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.1 pt -137.64 159.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -0.859 . . . . 0.0 110.614 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.406 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 81.1 m-85 -111.96 142.19 44.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.647 -0.658 . . . . 0.0 110.551 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.3 t -128.17 125.08 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.431 -0.793 . . . . 0.0 109.723 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.23 130.12 46.32 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.439 -0.788 . . . . 0.0 110.514 -179.652 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.595 HG22 HD23 ' B' ' 69' ' ' LEU . 19.7 p -95.79 177.66 5.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.44 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -16.19 42.18 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.431 -0.793 . . . . 0.0 111.007 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.9 19.59 11.24 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.038 -1.039 . . . . 0.0 110.693 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.9 12.8 58.17 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.2 OUTLIER -84.92 133.37 34.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.073 -1.251 . . . . 0.0 109.825 179.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.423 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 10.3 m -113.21 125.59 54.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 16.2 mt -109.13 136.67 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.384 -0.823 . . . . 0.0 110.466 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.406 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 11.4 m -102.19 118.52 37.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.412 -0.805 . . . . 0.0 109.222 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.0 mt -123.27 165.29 17.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.137 -0.977 . . . . 0.0 110.883 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -106.35 117.12 33.21 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.381 -0.825 . . . . 0.0 109.743 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.546 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.4 m -140.42 176.21 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.331 -0.856 . . . . 0.0 110.712 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.561 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.8 mp0 -113.06 163.86 16.98 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.571 -0.706 . . . . 0.0 109.137 178.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.06 -27.17 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.507 1.267 . . . . 0.0 110.332 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.3 p -84.71 -3.11 58.4 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.099 -1.0 . . . . 0.0 110.704 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -71.38 140.08 50.02 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.097 -1.002 . . . . 0.0 110.687 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.43 161.37 21.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.551 -0.718 . . . . 0.0 110.371 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 1.081 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.14 -34.03 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.733 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -60.61 -37.76 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -0.941 . . . . 0.0 109.339 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -31.24 68.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.445 -0.784 . . . . 0.0 109.425 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 88.3 t -70.28 -42.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.411 -0.806 . . . . 0.0 109.38 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.501 ' HE3' HG22 ' B' ' 23' ' ' ILE . 34.8 mttt -63.0 -41.77 99.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.474 -0.766 . . . . 0.0 109.251 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -35.22 76.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.446 -0.784 . . . . 0.0 109.282 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.546 ' CD ' HG12 ' B' ' 17' ' ' VAL . 8.4 mttm -68.3 -38.18 81.37 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 109.661 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.6 mt -67.3 -40.31 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.103 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.52 -49.63 76.79 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.449 -0.782 . . . . 0.0 109.462 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.12 -26.53 62.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.326 -0.859 . . . . 0.0 110.314 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -83.91 -41.24 17.62 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.406 -0.809 . . . . 0.0 110.739 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.06 -56.1 2.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.264 -0.898 . . . . 0.0 110.417 -179.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.57 19.57 1.65 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.504 HG23 ' HD2' ' B' ' 37' ' ' PRO . 22.6 mt -91.31 143.89 28.95 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.061 -1.258 . . . . 0.0 109.644 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.504 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.3 Cg_endo -68.2 133.64 29.18 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.614 1.323 . . . . 0.0 110.482 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.77 -23.81 77.35 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.79 1.416 . . . . 0.0 110.991 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.82 -23.77 64.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.252 -0.905 . . . . 0.0 109.762 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.503 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.38 0.63 40.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.428 -0.795 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -94.22 137.61 33.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.198 -0.939 . . . . 0.0 110.407 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -130.12 132.01 45.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 1.081 HD12 HG23 ' B' ' 23' ' ' ILE . 39.2 mt -104.79 118.03 35.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.398 -0.814 . . . . 0.0 110.673 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.78 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.33 133.41 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.5 -0.75 . . . . 0.0 109.797 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 11.4 t80 -141.25 155.54 46.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.397 -0.814 . . . . 0.0 109.977 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.426 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 44.7 24.75 0.11 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.424 -0.797 . . . . 0.0 111.558 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.8 -8.86 67.56 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.119 -1.039 . . . . 0.0 110.851 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' B' ' 45' ' ' PHE . 9.2 ptmt -110.69 142.14 43.0 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.809 -1.406 . . . . 0.0 110.484 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.4 137.26 37.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.346 -0.846 . . . . 0.0 109.908 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.797 HD22 ' CG ' ' B' ' 59' ' ' TYR . 24.9 mt -83.79 148.84 26.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.333 -0.854 . . . . 0.0 110.346 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -93.48 130.25 39.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.298 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.56 -28.13 3.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.494 -0.754 . . . . 0.0 111.079 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 -3.05 90.66 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.405 ' O ' HD13 ' B' ' 23' ' ' ILE . 12.2 mmt180 -99.49 155.99 17.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.126 -1.22 . . . . 0.0 110.346 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.55 163.19 12.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.388 -0.82 . . . . 0.0 110.182 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.581 ' HA ' HD12 ' B' ' 61' ' ' ILE . 85.9 mt -53.24 -45.74 68.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.281 -0.887 . . . . 0.0 110.574 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.5 t -56.93 -35.89 69.58 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.415 -0.803 . . . . 0.0 110.838 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -59.6 -29.43 67.97 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.307 -0.871 . . . . 0.0 110.44 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.797 ' CG ' HD22 ' B' ' 50' ' ' LEU . 41.8 m-85 -101.07 28.48 5.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.352 -0.843 . . . . 0.0 109.977 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 26.2 m-20 50.7 28.23 3.45 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.512 -0.743 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.702 HD13 HD21 ' B' ' 67' ' ' LEU . 88.0 mt -81.47 110.19 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.394 -0.816 . . . . 0.0 109.876 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -105.62 172.48 6.77 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.282 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.3 pttt -46.62 151.97 0.52 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.477 -0.765 . . . . 0.0 110.995 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 4.0 mm-40 62.76 15.94 8.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.783 -0.573 . . . . 0.0 110.623 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.61 145.23 49.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.929 . . . . 0.0 110.162 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 39.8 m -107.76 109.78 21.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.842 . . . . 0.0 110.082 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.702 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.29 161.58 13.58 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.345 -0.847 . . . . 0.0 110.043 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -108.64 132.01 54.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 109.909 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.595 HD23 HG22 ' B' ' 7' ' ' THR . 32.9 tp -107.05 136.09 47.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.318 -0.864 . . . . 0.0 110.165 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.862 . . . . 0.0 109.953 179.969 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.25 0.548 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.31 -30.13 57.6 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.222 -0.924 . . . . 0.0 109.119 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.883 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mp -64.99 -29.06 69.96 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 tt -76.44 -37.57 56.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 0.0 109.769 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.435 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.8 OUTLIER -83.51 -55.84 4.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.297 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.2 tpt -52.12 -45.35 64.91 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.203 -0.936 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.0 m -66.22 -42.64 88.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.343 -0.848 . . . . 0.0 110.474 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.435 HG22 ' HA ' ' A' ' 68' ' ' LYS . 4.5 tp -82.78 -6.39 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 0.0 110.368 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -82.26 -46.68 13.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 110.044 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -83.74 -20.88 32.6 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.362 -0.836 . . . . 0.0 110.433 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.465 -179.812 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 74.7 p . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.419 0.628 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.527 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.0 pt-20 -68.61 -28.85 67.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.582 -0.699 . . . . 0.0 109.279 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.437 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 33.6 mt-10 -85.61 -40.68 15.97 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 179.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -64.85 -43.71 92.13 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -66.74 -34.12 77.13 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.527 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.41 -35.75 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -38.44 91.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.486 -0.759 . . . . 0.0 109.485 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.68 -42.54 64.17 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.94 92.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.46 -0.775 . . . . 0.0 110.018 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 34.6 mmm -75.53 -22.41 57.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.419 -0.801 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.482 0 O-C-N 121.545 -0.722 . . . . 0.0 109.902 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.204 0.526 . . . . 0.0 110.35 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.67 134.42 47.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.409 -0.807 . . . . 0.0 109.555 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 13.2 pt -136.9 155.6 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 109.943 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -111.64 144.28 41.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.559 -0.713 . . . . 0.0 111.04 -179.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.2 t -127.82 117.77 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.476 -0.765 . . . . 0.0 109.262 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.29 133.95 43.95 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.507 -0.746 . . . . 0.0 110.894 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 72.1 p -96.4 172.08 8.17 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 39.7 mt -61.7 -11.58 12.57 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.405 -0.809 . . . . 0.0 111.017 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.4 p -95.61 0.22 52.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.015 -1.053 . . . . 0.0 110.909 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.46 9.11 67.26 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.5 tttp -84.61 126.09 33.04 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.089 -1.242 . . . . 0.0 109.859 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.0 m -112.97 123.39 50.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.303 -0.873 . . . . 0.0 110.284 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.404 HD13 HG21 ' B' ' 13' ' ' ILE . 17.9 mt -109.23 136.58 44.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.534 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.5 m -102.25 119.47 38.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.432 -0.792 . . . . 0.0 109.377 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.69 162.42 23.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.149 -0.969 . . . . 0.0 111.023 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.438 ' HA ' ' O ' ' B' ' 1' ' ' MET . 3.4 mm-40 -106.32 118.89 37.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.542 -0.724 . . . . 0.0 109.262 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.4 m -140.4 178.65 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.157 -0.964 . . . . 0.0 111.333 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.489 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.2 mm-40 -113.57 159.8 34.1 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -73.69 -24.95 15.25 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 O-C-N 123.403 1.212 . . . . 0.0 110.041 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.8 -4.62 59.15 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.241 -0.912 . . . . 0.0 110.328 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -71.14 144.99 50.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.176 -0.952 . . . . 0.0 110.573 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 71.8 p -83.25 158.24 22.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.484 -0.76 . . . . 0.0 110.329 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.525 ' CG2' HD12 ' B' ' 43' ' ' LEU . 46.0 mm -59.75 -32.31 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.841 . . . . 0.0 109.505 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.73 -36.96 84.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.421 -0.799 . . . . 0.0 109.251 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.3 -32.01 69.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.506 -0.746 . . . . 0.0 109.162 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . 0.427 HG21 HD21 ' B' ' 56' ' ' LEU . 58.4 t -70.13 -41.18 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.466 -0.771 . . . . 0.0 109.223 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -62.96 -41.64 99.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 109.151 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.57 -34.4 75.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.744 . . . . 0.0 109.422 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -68.03 -39.01 83.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.459 179.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.0 mt -66.94 -38.73 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.315 -0.866 . . . . 0.0 109.098 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -49.56 77.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.448 -0.782 . . . . 0.0 109.457 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.24 -27.21 63.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.516 -0.74 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.82 -40.94 18.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.252 -0.905 . . . . 0.0 110.875 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -108.04 -55.78 2.32 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.253 -0.904 . . . . 0.0 110.419 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.08 18.72 1.66 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.483 HG23 ' HD2' ' B' ' 37' ' ' PRO . 80.8 mt -91.38 143.12 27.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.13 -1.217 . . . . 0.0 109.944 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.483 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.8 Cg_endo -69.98 133.73 25.85 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 O-C-N 123.542 1.285 . . . . 0.0 110.492 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.81 -26.69 83.52 Favored 'Trans proline' 0 C--N 1.313 -1.321 0 O-C-N 123.618 1.325 . . . . 0.0 110.949 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.76 -24.25 64.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.357 -0.839 . . . . 0.0 109.968 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.432 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 28.8 mm-40 -101.43 0.59 37.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.288 -0.882 . . . . 0.0 110.441 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -94.38 140.25 30.05 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.14 -0.975 . . . . 0.0 110.447 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -130.14 128.43 41.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.453 -0.779 . . . . 0.0 109.797 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.905 ' HB3' HD12 ' B' ' 50' ' ' LEU . 32.5 mt -104.68 118.97 37.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.322 -0.861 . . . . 0.0 110.522 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.653 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.6 mp -121.36 135.98 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.506 -0.746 . . . . 0.0 109.922 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -140.83 151.2 44.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.468 -0.77 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.37 28.27 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.511 -0.743 . . . . 0.0 111.195 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.54 1.44 76.64 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.01 137.67 48.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.07 -1.253 . . . . 0.0 110.175 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -78.33 139.13 38.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.258 -0.902 . . . . 0.0 109.998 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.905 HD12 ' HB3' ' B' ' 43' ' ' LEU . 55.1 mt -83.89 143.45 29.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.333 -0.855 . . . . 0.0 110.348 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.62 126.52 38.83 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.505 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.463 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.8 p30 -48.69 -29.73 4.75 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.444 -0.785 . . . . 0.0 111.132 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -6.15 88.69 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -99.47 158.6 15.62 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.025 -1.279 . . . . 0.0 110.388 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.5 p -102.06 164.12 11.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.438 -0.789 . . . . 0.0 110.288 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.61 ' HA ' HD12 ' B' ' 61' ' ' ILE . 92.9 mt -53.86 -45.7 71.04 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.341 -0.849 . . . . 0.0 110.751 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 55.4 p -56.58 -34.17 66.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.303 -0.873 . . . . 0.0 111.198 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -59.52 -27.65 66.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.094 -1.004 . . . . 0.0 110.374 -179.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.475 ' CG ' HD22 ' B' ' 50' ' ' LEU . 70.5 m-85 -101.12 27.02 6.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.857 . . . . 0.0 109.983 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.92 32.35 7.28 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.61 HD12 ' HA ' ' B' ' 56' ' ' LEU . 97.7 mt -81.56 108.91 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.286 -0.884 . . . . 0.0 109.869 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -105.64 173.67 6.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.374 -0.829 . . . . 0.0 110.346 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.4 ptmt -46.62 152.1 0.5 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.59 -0.694 . . . . 0.0 111.17 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.3 mm-40 62.84 15.47 8.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.792 -0.568 . . . . 0.0 110.841 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.64 139.17 49.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -107.37 111.05 23.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.927 . . . . 0.0 110.03 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.444 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mp -102.29 164.0 11.92 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.28 -0.888 . . . . 0.0 110.022 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -108.88 130.7 55.43 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 109.996 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 tp -107.19 133.67 51.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.883 . . . . 0.0 110.286 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 27.7 t . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.405 -0.809 . . . . 0.0 109.958 179.805 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t0 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.27 0.557 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -74.6 -28.13 60.77 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.183 -0.948 . . . . 0.0 109.161 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.93 97.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.931 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.29 -29.2 69.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.1 tt -75.17 -43.46 52.1 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.482 -0.762 . . . . 0.0 109.891 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.423 -0.798 . . . . 0.0 110.482 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -39.87 61.48 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.144 -0.972 . . . . 0.0 110.671 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.7 m -69.43 -41.31 76.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.299 -0.876 . . . . 0.0 110.453 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.2 tp -82.18 -16.4 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.114 -0.991 . . . . 0.0 110.134 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -74.61 -33.74 62.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.3 -0.875 . . . . 0.0 109.748 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -27.71 23.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.469 -0.77 . . . . 0.0 109.93 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.338 -0.851 . . . . 0.0 110.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.1 p . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.336 0.588 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.572 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.9 pt-20 -67.14 -31.29 71.63 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.543 -0.723 . . . . 0.0 109.175 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.455 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.9 OUTLIER -85.48 -40.75 16.03 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -42.56 99.75 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -69.8 -35.92 75.24 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 178.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.572 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.76 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.798 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.67 72.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.541 -0.724 . . . . 0.0 109.802 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.21 -52.7 7.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.481 -0.762 . . . . 0.0 110.09 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.0 -33.09 74.94 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.4 -0.812 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.2 ttm -80.2 -21.52 42.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 109.824 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.422 -0.799 . . . . 0.0 110.071 179.878 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.26 0.552 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . 0.443 ' HG2' HG22 ' B' ' 14' ' ' THR . 0.4 OUTLIER -97.24 145.38 26.12 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.502 -0.749 . . . . 0.0 109.903 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 12.7 pt -137.65 159.47 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.344 -0.848 . . . . 0.0 110.17 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -111.85 142.82 43.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.582 -0.699 . . . . 0.0 110.754 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -127.76 118.16 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.476 -0.765 . . . . 0.0 109.503 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 30.2 mttt -100.25 135.19 42.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 110.607 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -96.04 170.04 9.56 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.454 -0.779 . . . . 0.0 110.189 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.693 HD11 HG13 ' B' ' 70' ' ' VAL . 8.3 mt -61.82 -9.27 6.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.459 -0.776 . . . . 0.0 111.203 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.9 p -95.27 -13.34 24.94 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.081 -1.012 . . . . 0.0 110.564 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 6.16 40.26 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.238 -1.145 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 56.7 tttt -84.61 128.56 34.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.113 -1.228 . . . . 0.0 110.049 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.8 m -113.23 125.21 54.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.303 -0.873 . . . . 0.0 110.08 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.4 mt -109.12 135.13 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.439 -0.788 . . . . 0.0 110.522 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.443 HG22 ' HG2' ' B' ' 2' ' ' GLN . 3.1 m -102.43 118.0 35.93 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.516 -0.74 . . . . 0.0 109.26 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -123.38 166.45 15.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.156 -0.965 . . . . 0.0 110.821 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.5 115.11 29.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.441 -0.787 . . . . 0.0 109.528 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.441 HG12 ' CD ' ' B' ' 29' ' ' LYS . 21.5 m -140.51 170.26 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.282 -0.886 . . . . 0.0 110.823 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -112.7 164.62 14.95 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.586 -0.696 . . . . 0.0 109.185 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -70.94 -25.51 23.04 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.569 1.3 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.36 -3.93 58.58 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.444 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -71.31 143.6 50.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.559 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.6 p -83.21 156.66 23.06 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.547 -0.72 . . . . 0.0 110.446 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 31.4 mm -59.67 -34.77 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.383 -0.823 . . . . 0.0 109.616 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.74 -36.92 82.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.34 -0.85 . . . . 0.0 109.33 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.2 -32.21 70.02 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.353 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.36 -39.2 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.451 -0.78 . . . . 0.0 109.049 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -63.14 -43.78 97.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.103 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.05 73.13 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.463 -0.773 . . . . 0.0 109.469 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.441 ' CD ' HG12 ' B' ' 17' ' ' VAL . 19.6 mttm -68.07 -40.26 82.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.495 -0.753 . . . . 0.0 109.543 179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.423 HD13 HD22 ' B' ' 69' ' ' LEU . 18.0 mt -67.1 -37.14 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.586 -0.845 . . . . 0.0 109.03 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -60.83 -52.72 63.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.474 -0.767 . . . . 0.0 109.644 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -27.46 63.7 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.712 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -84.0 -39.93 19.07 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.198 -0.939 . . . . 0.0 111.037 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -108.15 -54.19 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.278 -0.889 . . . . 0.0 110.512 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.81 16.64 2.19 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.264 -1.135 . . . . 0.0 110.264 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.495 HG23 ' HD2' ' B' ' 37' ' ' PRO . 93.5 mt -91.2 143.51 28.48 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.077 -1.249 . . . . 0.0 109.778 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.495 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -69.49 133.88 27.17 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.66 1.347 . . . . 0.0 110.556 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.83 -26.43 83.05 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.741 1.39 . . . . 0.0 110.81 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.78 -25.65 64.81 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.341 -0.85 . . . . 0.0 109.902 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.448 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 58.8 mm-40 -101.26 4.36 41.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.35 -0.844 . . . . 0.0 110.464 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.22 139.32 31.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.238 -0.914 . . . . 0.0 110.468 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -130.17 126.4 37.35 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.473 -0.767 . . . . 0.0 109.783 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.769 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.7 mt -104.64 117.91 35.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.251 -0.905 . . . . 0.0 110.376 -179.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.769 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.35 138.06 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.513 -0.742 . . . . 0.0 109.92 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.56 ' HB2' HD23 ' B' ' 67' ' ' LEU . 66.8 t80 -140.7 147.88 39.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.567 -0.708 . . . . 0.0 109.753 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 28.8 0.51 Allowed 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.416 -0.803 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.8 3.75 87.69 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.85 133.69 53.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.083 -1.245 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -78.49 134.3 37.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.064 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.881 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.9 mt -84.27 140.31 31.74 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.385 -0.822 . . . . 0.0 110.28 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -93.67 130.49 39.59 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.406 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.502 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.2 m-20 -48.43 -26.75 2.25 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.433 -0.792 . . . . 0.0 111.202 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.96 -8.05 86.33 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.702 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.479 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.34 159.04 15.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.01 -1.288 . . . . 0.0 110.432 -179.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.1 p -102.08 162.98 12.49 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.396 -0.815 . . . . 0.0 110.182 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.414 ' HA ' HD12 ' B' ' 61' ' ' ILE . 82.0 mt -53.45 -43.98 68.53 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.295 -0.878 . . . . 0.0 110.669 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.9 -34.72 68.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.413 -0.804 . . . . 0.0 111.131 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.5 -26.96 65.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.11 -0.994 . . . . 0.0 110.394 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.881 ' CD2' HD22 ' B' ' 50' ' ' LEU . 53.2 m-85 -101.15 26.21 7.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 110.053 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m120 50.63 31.06 5.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.541 -0.724 . . . . 0.0 110.728 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.5 mt -81.41 114.53 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.86 . . . . 0.0 109.784 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -105.55 167.86 9.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.384 -0.823 . . . . 0.0 110.219 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.9 pttt -46.54 153.13 0.39 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.479 -0.763 . . . . 0.0 111.041 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 21.0 mt-10 63.4 14.01 7.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.766 -0.584 . . . . 0.0 110.818 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.83 144.62 49.05 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.157 -0.964 . . . . 0.0 110.225 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.0 m -107.51 110.9 22.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.331 -0.856 . . . . 0.0 109.818 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.56 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.7 mt -102.38 165.03 11.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.252 -0.905 . . . . 0.0 110.344 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -108.82 129.53 55.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.358 -0.839 . . . . 0.0 110.125 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.423 HD22 HD13 ' B' ' 30' ' ' ILE . 60.3 tp -107.34 131.24 54.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.693 HG13 HD11 ' B' ' 8' ' ' LEU . 47.1 t . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.423 -0.798 . . . . 0.0 110.18 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.5 t0 . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.173 0.511 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.18 -28.89 61.51 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.243 -0.91 . . . . 0.0 109.075 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.47 96.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.939 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.4 tp -65.08 -28.35 69.4 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.568 ' C ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -73.45 -48.35 34.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.535 -0.728 . . . . 0.0 109.563 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.63 -52.95 7.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 110.545 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 tpt -51.73 -38.78 56.77 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.232 -0.917 . . . . 0.0 110.824 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.3 m -71.11 -40.65 71.33 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.264 -0.898 . . . . 0.0 110.396 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 tp -83.65 -13.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.973 . . . . 0.0 110.226 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -76.28 -48.43 20.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.293 -0.88 . . . . 0.0 109.784 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -25.41 47.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 110.064 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.831 . . . . 0.0 110.223 -179.964 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 75.4 p . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.364 0.602 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.545 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -67.24 -31.83 72.44 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.477 -0.764 . . . . 0.0 109.248 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 27.3 mt-10 -85.44 -40.61 16.22 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -63.89 -42.26 97.52 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.1 -35.39 76.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.545 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.31 -36.83 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.87 -29.76 69.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 109.616 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -83.82 -38.51 21.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.466 -0.772 . . . . 0.0 110.057 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -79.57 -28.98 41.12 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.329 -0.857 . . . . 0.0 110.469 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -83.96 -31.83 25.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.3 -0.875 . . . . 0.0 109.73 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.505 -0.747 . . . . 0.0 110.008 179.844 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.4 ttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.303 0.573 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -112.96 140.19 47.97 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.374 -0.829 . . . . 0.0 109.606 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.504 HD13 HG21 ' B' ' 17' ' ' VAL . 43.2 pt -137.72 157.15 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.212 -0.93 . . . . 0.0 110.535 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -111.89 144.89 40.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.598 -0.689 . . . . 0.0 110.546 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 68.4 t -128.13 122.38 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.342 -0.849 . . . . 0.0 109.603 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.469 ' HG3' HG23 ' B' ' 12' ' ' THR . 12.0 mttt -100.16 131.98 45.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.689 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.4 p -95.79 175.71 6.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.431 -0.793 . . . . 0.0 109.921 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 22.1 mt -61.57 -12.77 16.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.309 -0.869 . . . . 0.0 111.17 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.2 p -95.73 14.5 22.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.007 -1.058 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.84 8.34 68.1 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.432 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 24.5 tttt -84.79 134.02 34.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.066 -1.256 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.469 HG23 ' HG3' ' B' ' 6' ' ' LYS . 5.3 m -113.26 130.28 56.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -0.881 . . . . 0.0 110.318 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 mt -109.15 141.89 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.401 -0.812 . . . . 0.0 110.239 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 8.5 m -101.84 121.94 43.05 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.441 -0.787 . . . . 0.0 109.504 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.443 HD23 ' HE2' ' B' ' 33' ' ' LYS . 4.6 mt -123.27 156.27 35.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.16 -0.963 . . . . 0.0 110.831 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 113.95 27.79 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.422 -0.798 . . . . 0.0 109.422 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.691 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.2 m -139.9 178.46 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.309 -0.869 . . . . 0.0 110.856 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.609 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -113.01 166.14 11.7 Favored Pre-proline 0 N--CA 1.489 1.492 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.27 -28.86 14.81 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.469 1.247 . . . . 0.0 110.277 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.44 -0.68 53.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.63 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -71.21 142.71 50.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.38 159.51 21.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.537 -0.727 . . . . 0.0 110.498 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.861 HG23 HD12 ' B' ' 43' ' ' LEU . 44.1 mm -59.71 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.363 -0.836 . . . . 0.0 109.565 179.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -36.88 74.74 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.385 -0.822 . . . . 0.0 109.425 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -70.06 -31.17 68.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.495 -0.753 . . . . 0.0 109.208 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 22' ' ' THR . 58.2 t -70.24 -39.89 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 119.839 -0.745 . . . . 0.0 109.134 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -63.26 -43.05 99.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.502 -0.749 . . . . 0.0 109.178 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.9 76.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.502 -0.749 . . . . 0.0 109.49 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.691 ' CD ' HG12 ' B' ' 17' ' ' VAL . 30.4 mttm -68.12 -38.32 82.09 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.501 -0.749 . . . . 0.0 109.491 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.19 -39.73 83.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.415 -0.803 . . . . 0.0 109.111 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' B' ' 35' ' ' GLY . 13.9 tt0 -60.61 -47.86 84.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.301 -0.875 . . . . 0.0 109.299 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -58.01 -27.76 63.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.407 -0.808 . . . . 0.0 110.241 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.443 ' HE2' HD23 ' B' ' 15' ' ' LEU . 2.9 mmtm -84.27 -41.26 17.06 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.399 -0.813 . . . . 0.0 110.874 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -107.76 -55.79 2.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.248 -0.907 . . . . 0.0 110.365 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.8 21.27 1.77 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.524 HG23 ' HD2' ' B' ' 37' ' ' PRO . 56.8 mt -91.65 144.4 29.44 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.197 -1.178 . . . . 0.0 109.976 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.524 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -68.51 131.83 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.536 1.282 . . . . 0.0 110.622 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.96 -24.61 79.87 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.653 1.344 . . . . 0.0 110.714 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.61 -25.4 64.84 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.829 . . . . 0.0 109.731 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.429 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 4.4 mt-30 -101.33 0.1 36.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.49 -0.756 . . . . 0.0 110.425 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -94.44 137.22 33.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.201 -0.937 . . . . 0.0 110.475 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.22 134.69 47.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.454 -0.779 . . . . 0.0 109.765 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.861 HD12 HG23 ' B' ' 23' ' ' ILE . 18.0 mt -104.67 116.59 32.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.217 -0.927 . . . . 0.0 110.333 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.788 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.2 mp -121.21 135.14 62.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.463 -0.773 . . . . 0.0 109.831 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.526 ' HB2' HD23 ' B' ' 67' ' ' LEU . 25.8 t80 -140.69 145.98 37.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.338 -0.851 . . . . 0.0 109.767 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.66 28.93 0.59 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.741 . . . . 0.0 110.932 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.56 5.1 88.02 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -111.03 128.71 55.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.166 -1.197 . . . . 0.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 132.48 37.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 109.589 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.845 HD22 ' CD2' ' B' ' 59' ' ' TYR . 48.9 mt -83.74 142.96 30.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.223 -0.923 . . . . 0.0 110.274 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -93.5 133.12 37.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.486 -0.759 . . . . 0.0 110.442 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.478 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 65.9 m-20 -48.54 -28.18 3.22 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.565 -0.709 . . . . 0.0 111.027 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -5.85 88.81 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 120.116 -1.04 . . . . 0.0 110.692 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.455 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 11.2 mmt180 -99.51 153.57 18.92 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.027 -1.278 . . . . 0.0 110.488 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.6 p -102.23 165.63 11.03 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.291 -0.881 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.609 HD12 ' O ' ' B' ' 18' ' ' GLU . 87.8 mt -53.6 -45.66 70.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.29 -0.881 . . . . 0.0 110.78 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -56.82 -38.39 72.54 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.432 -0.792 . . . . 0.0 110.958 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -59.68 -27.93 66.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.325 -0.86 . . . . 0.0 110.425 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.845 ' CD2' HD22 ' B' ' 50' ' ' LEU . 40.8 m-85 -100.98 26.72 6.67 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.954 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 50.69 27.39 2.97 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.569 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.565 HG21 HD22 ' B' ' 56' ' ' LEU . 88.0 mt -81.37 109.46 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.377 -0.827 . . . . 0.0 109.79 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.54 172.11 6.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.426 -0.796 . . . . 0.0 110.164 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.44 152.73 0.42 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.547 -0.721 . . . . 0.0 111.084 -179.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.7 mm-40 63.0 16.55 9.37 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.81 -0.556 . . . . 0.0 110.595 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.63 145.66 48.82 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.3 m -107.91 108.05 19.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.526 HD23 ' HB2' ' B' ' 45' ' ' PHE . 10.3 mt -102.54 157.96 16.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.29 -0.881 . . . . 0.0 110.091 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -108.88 138.52 45.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.254 -0.904 . . . . 0.0 109.995 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 45.9 tp -106.95 133.16 52.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.349 -0.845 . . . . 0.0 110.276 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 110.405 -179.817 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.9 t70 . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 121.137 0.494 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -75.1 -28.92 60.45 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.246 -0.909 . . . . 0.0 109.145 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.92 97.66 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.685 -0.806 . . . . 0.0 108.869 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -28.62 69.44 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -75.69 -45.78 34.95 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.598 -0.688 . . . . 0.0 109.869 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.447 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.01 -53.51 6.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.484 -0.76 . . . . 0.0 110.487 -179.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.92 -40.37 60.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.139 -0.976 . . . . 0.0 110.643 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.2 m -69.43 -41.17 76.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.259 -0.9 . . . . 0.0 110.423 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.447 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.0 tp -85.38 -10.62 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.076 -1.015 . . . . 0.0 110.466 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 30.3 t -80.32 -36.27 34.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.717 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -89.25 -23.87 22.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.54 -0.725 . . . . 0.0 110.067 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.344 -0.847 . . . . 0.0 110.461 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.492 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.7 p . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.3 0.571 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.543 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.9 pt-20 -69.49 -29.45 67.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.511 -0.743 . . . . 0.0 109.365 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.437 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.7 OUTLIER -84.7 -38.41 19.77 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.492 ' HB2' ' N ' ' A' ' 88' ' ' THR . 10.0 mm-40 -66.52 -43.77 84.29 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -66.6 -35.39 80.09 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.543 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.8 -35.74 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.703 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.2 -38.84 92.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.622 -0.674 . . . . 0.0 109.402 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -44.89 59.23 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.508 -0.745 . . . . 0.0 109.95 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.77 82.16 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.414 -0.804 . . . . 0.0 110.019 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 20.5 mmt -79.32 -24.64 42.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.31 -0.869 . . . . 0.0 109.628 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 0.0 109.991 179.837 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.461 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.4 ttp . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.241 0.543 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -88.09 140.78 29.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.0 109.717 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.492 HD13 HG21 ' B' ' 17' ' ' VAL . 35.3 pt -137.37 157.65 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.257 -0.902 . . . . 0.0 110.259 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.8 144.31 41.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.654 -0.654 . . . . 0.0 110.598 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 12' ' ' THR . 61.3 t -128.16 126.02 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 109.659 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.43 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -99.81 138.45 36.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.285 -0.885 . . . . 0.0 110.636 -179.501 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 74.2 p -95.85 171.56 8.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.479 -0.763 . . . . 0.0 110.481 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.34 -14.05 24.16 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -0.813 . . . . 0.0 111.164 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.2 p -95.6 -23.6 16.97 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.092 -1.005 . . . . 0.0 110.75 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.59 10.94 8.98 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.3 ttpm? -84.57 137.42 33.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.268 . . . . 0.0 109.797 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 10.0 m -113.12 126.31 55.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.291 -0.881 . . . . 0.0 110.306 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 mt -108.96 136.3 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.411 -0.806 . . . . 0.0 110.255 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.4 m -101.85 121.09 41.45 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 109.319 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mt -123.3 159.37 28.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.192 -0.943 . . . . 0.0 110.858 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -106.35 113.71 27.39 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.183 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.655 HG12 ' HD2' ' B' ' 29' ' ' LYS . 33.8 m -140.19 174.34 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.331 -0.856 . . . . 0.0 110.951 -178.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.618 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.4 OUTLIER -112.9 165.41 13.19 Favored Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.637 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.92 -26.97 18.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.525 1.276 . . . . 0.0 110.326 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.39 -2.63 57.46 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 110.522 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.58 142.28 50.03 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 65.8 p -83.41 160.5 21.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.704 . . . . 0.0 110.485 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.674 HG23 HD12 ' B' ' 43' ' ' LEU . 42.0 mm -59.64 -35.64 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.619 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.86 -35.88 75.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.197 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -32.21 69.53 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.536 -0.728 . . . . 0.0 109.29 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 72.4 t -69.96 -42.84 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.499 -0.751 . . . . 0.0 109.387 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -62.88 -40.69 98.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.466 -0.771 . . . . 0.0 109.324 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -36.46 81.03 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.682 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.655 ' HD2' HG12 ' B' ' 17' ' ' VAL . 40.4 mttp -68.15 -38.12 81.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 0.0 109.688 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mt -67.02 -39.59 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.374 -0.829 . . . . 0.0 109.119 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.2 tm0? -60.48 -48.89 79.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.429 -0.794 . . . . 0.0 109.422 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.08 -26.55 62.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.787 . . . . 0.0 110.25 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -84.07 -39.97 18.9 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -108.03 -55.97 2.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.316 -0.865 . . . . 0.0 110.622 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.02 15.7 2.29 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.519 HG23 ' HD2' ' B' ' 37' ' ' PRO . 60.7 mt -91.38 144.62 29.99 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.134 -1.215 . . . . 0.0 109.849 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.519 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -69.77 134.64 28.45 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.546 1.287 . . . . 0.0 110.454 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -61.02 -26.59 83.34 Favored 'Trans proline' 0 C--N 1.312 -1.376 0 O-C-N 123.793 1.417 . . . . 0.0 111.152 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.92 -19.67 64.2 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.26 -0.9 . . . . 0.0 110.228 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.465 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.4 mp0 -100.98 -9.42 21.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 110.753 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . 0.416 ' HB3' HD11 ' B' ' 69' ' ' LEU . 19.2 mt-30 -94.35 145.7 24.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.166 -0.959 . . . . 0.0 110.873 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.463 ' HG2' HD11 ' B' ' 44' ' ' ILE . 3.6 ttt85 -130.18 134.25 47.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.514 -0.742 . . . . 0.0 109.522 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.786 ' C ' HD12 ' B' ' 44' ' ' ILE . 25.8 mt -104.34 117.54 34.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.423 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.786 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.1 mp -121.2 133.68 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.633 -0.667 . . . . 0.0 109.742 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.419 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 28.4 t80 -140.63 151.44 44.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.454 -0.779 . . . . 0.0 109.902 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.419 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.42 27.41 0.37 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.491 -0.756 . . . . 0.0 111.243 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.81 -0.82 81.16 Favored Glycine 0 N--CA 1.495 2.594 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.605 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.87 136.0 50.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.069 -1.254 . . . . 0.0 110.275 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.5 137.06 37.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.88 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.711 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.5 mt -84.1 139.9 32.16 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.0 110.324 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -93.61 134.71 35.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.306 -0.871 . . . . 0.0 110.465 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.454 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.7 p-10 -48.6 -30.89 5.84 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.495 -0.753 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.01 -4.02 90.18 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 23.6 mmt180 -99.63 153.54 18.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.053 -1.263 . . . . 0.0 110.652 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 78.4 p -102.33 163.42 12.24 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.333 -0.854 . . . . 0.0 110.222 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.618 HD12 ' O ' ' B' ' 18' ' ' GLU . 71.9 mt -53.52 -43.87 68.68 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.223 -0.923 . . . . 0.0 110.616 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 85.8 p -56.67 -37.33 70.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.389 -0.819 . . . . 0.0 111.051 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.44 -26.46 65.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.185 -0.947 . . . . 0.0 110.354 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.711 ' CD2' HD22 ' B' ' 50' ' ' LEU . 70.0 m-85 -101.24 25.11 8.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.177 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t30 50.52 29.21 3.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.477 -0.764 . . . . 0.0 110.726 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.662 HD13 HD21 ' B' ' 67' ' ' LEU . 94.1 mt -81.39 112.45 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 109.759 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -105.57 170.77 7.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.373 -0.829 . . . . 0.0 110.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.0 OUTLIER -46.53 151.89 0.51 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.56 -0.713 . . . . 0.0 111.04 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 52.2 mm-40 62.86 16.44 9.11 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.714 -0.616 . . . . 0.0 110.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 147.7 47.22 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.907 . . . . 0.0 110.205 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -107.66 109.22 20.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.374 -0.828 . . . . 0.0 109.878 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.662 HD21 HD13 ' B' ' 61' ' ' ILE . 1.3 mt -102.23 158.85 15.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.322 -0.862 . . . . 0.0 110.019 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -108.77 131.98 54.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.86 . . . . 0.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.416 HD11 ' HB3' ' B' ' 41' ' ' GLN . 31.0 tp -107.19 136.08 47.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.35 -0.844 . . . . 0.0 110.009 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 19.0 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 121.271 -0.893 . . . . 0.0 110.222 -179.893 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.46 -178.66 3.43 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.336 -0.852 . . . . 0.0 110.169 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.6 mp -112.41 25.74 11.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.533 -0.729 . . . . 0.0 109.485 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.87 -40.28 7.7 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt 52.22 83.02 0.06 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.31 -1.112 . . . . 0.0 110.478 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -97.99 78.44 0.61 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -130.0 -63.48 0.91 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.405 -1.056 . . . . 0.0 110.248 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.05 28.68 4.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.374 -0.829 . . . . 0.0 110.222 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.46 -24.84 19.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.446 -0.784 . . . . 0.0 110.186 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -90.37 -28.32 18.77 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.296 -0.878 . . . . 0.0 110.297 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.22 34.01 3.08 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.343 -0.848 . . . . 0.0 110.312 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.17 -42.18 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.363 -0.836 . . . . 0.0 110.098 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -68.38 -24.45 75.0 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.624 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 35.2 m -125.69 -38.77 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.209 -1.171 . . . . 0.0 110.407 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.453 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.1 OUTLIER 57.44 176.93 0.04 OUTLIER Pre-proline 0 N--CA 1.496 1.841 0 O-C-N 121.207 -0.933 . . . . 0.0 109.807 -179.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 42.6 Cg_endo -69.29 -20.99 36.3 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.545 1.287 . . . . 0.0 110.4 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 35.3 t -72.3 -13.1 61.41 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.322 -0.861 . . . . 0.0 110.388 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.624 ' HB2' ' O ' ' A' ' 14' ' ' VAL . . . -83.74 -25.65 30.37 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.176 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.44 ' N ' ' OD1' ' A' ' 19' ' ' ASP . 33.9 p-10 -165.28 116.31 0.87 Allowed Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.338 -0.851 . . . . 0.0 110.383 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.12 -14.75 35.3 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 O-C-N 123.998 1.525 . . . . 0.0 109.875 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.39 -29.83 66.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.438 -0.789 . . . . 0.0 109.123 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.428 HD13 ' OD2' ' A' ' 19' ' ' ASP . 0.1 OUTLIER -89.18 -32.09 17.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.604 -0.685 . . . . 0.0 109.285 179.199 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.78 -32.48 59.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.464 -0.772 . . . . 0.0 109.535 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.605 ' O ' HG23 ' A' ' 28' ' ' VAL . 37.7 tp -79.91 -37.25 35.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.426 -0.797 . . . . 0.0 109.843 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.17 -36.36 83.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.371 -0.831 . . . . 0.0 109.911 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.466 ' O ' HD23 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -80.75 -21.3 41.21 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.426 -0.796 . . . . 0.0 110.31 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -80.27 -28.0 38.45 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.304 -0.873 . . . . 0.0 109.303 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 24' ' ' LEU . 83.2 t -81.28 -32.86 12.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.623 -0.673 . . . . 0.0 109.629 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.19 -41.52 49.26 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.394 -0.816 . . . . 0.0 110.038 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.0 mmm -66.08 -37.45 85.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.347 -0.846 . . . . 0.0 109.985 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.48 -42.49 92.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.317 -0.864 . . . . 0.0 110.031 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -61.23 -34.03 74.46 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.427 -0.796 . . . . 0.0 110.146 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -72.7 -39.15 67.21 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.362 -0.836 . . . . 0.0 110.132 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -48.43 78.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.257 -0.902 . . . . 0.0 109.769 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -29.96 66.7 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.434 -0.791 . . . . 0.0 109.754 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -82.95 -38.03 23.32 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.442 -0.786 . . . . 0.0 109.815 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.596 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -62.31 -37.57 86.09 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.442 -0.786 . . . . 0.0 109.946 179.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.4 -57.25 3.97 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.491 -0.756 . . . . 0.0 109.5 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.73 -30.56 33.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.483 -0.761 . . . . 0.0 109.304 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -88.07 -33.19 18.39 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.59 -0.694 . . . . 0.0 109.207 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.1 -46.62 83.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.371 -0.831 . . . . 0.0 109.582 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 12.9 ptt85 -73.0 -32.67 65.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.414 -0.804 . . . . 0.0 109.8 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -37.17 63.77 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.397 -0.815 . . . . 0.0 109.317 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.82 -28.85 44.5 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 42' ' ' ARG . . . -60.04 -28.17 67.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.585 -0.697 . . . . 0.0 109.675 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -93.65 -27.95 16.27 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.497 -0.752 . . . . 0.0 110.073 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -75.37 -29.08 59.77 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.337 -0.852 . . . . 0.0 110.071 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.57 -31.65 14.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.393 -0.817 . . . . 0.0 110.218 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.11 -25.33 60.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.34 -0.85 . . . . 0.0 110.29 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.77 -28.04 20.74 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.248 -0.908 . . . . 0.0 110.255 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 0.0 OUTLIER -90.24 -42.04 11.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.336 -0.852 . . . . 0.0 110.116 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -109.41 36.22 3.02 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.382 -0.824 . . . . 0.0 110.207 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.38 -75.46 0.04 OUTLIER Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.8 pp -78.58 -23.43 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.337 -1.096 . . . . 0.0 110.386 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 51' ' ' GLU . . . -80.44 59.13 3.37 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.353 -0.842 . . . . 0.0 110.21 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 29.8 p -147.02 157.91 43.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.345 -0.847 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.4 p -84.63 -170.89 3.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.267 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.64 -104.02 0.23 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -137.46 79.3 1.74 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -1.088 . . . . 0.0 110.222 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.75 71.37 0.79 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.371 -0.831 . . . . 0.0 110.153 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -67.74 -58.67 4.23 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.316 -0.865 . . . . 0.0 110.373 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.505 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 3.1 m -113.85 69.57 0.71 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.406 -0.809 . . . . 0.0 110.332 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -77.28 -54.78 6.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.12 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.18 -27.11 60.66 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.22 -0.925 . . . . 0.0 109.084 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.505 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -62.39 -42.17 99.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.629 -0.829 . . . . 0.0 108.807 179.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.54 -30.38 70.67 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.44 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -77.1 -35.22 56.56 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.569 -0.707 . . . . 0.0 109.774 179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.79 -55.91 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.45 -0.781 . . . . 0.0 110.337 -179.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -44.29 67.19 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.193 -0.942 . . . . 0.0 110.536 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 97.2 m -67.06 -44.69 79.48 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.409 -0.807 . . . . 0.0 110.618 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.8 tp -80.52 -12.08 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.275 -0.891 . . . . 0.0 110.259 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.422 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.6 m -76.05 -41.52 50.45 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.314 -0.866 . . . . 0.0 109.76 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -82.26 -24.56 34.71 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.452 -0.78 . . . . 0.0 110.124 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -86.05 -35.78 20.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.309 -0.869 . . . . 0.0 110.366 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -74.28 -45.03 50.29 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.297 -0.877 . . . . 0.0 110.34 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -64.78 -27.67 69.05 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.285 -0.885 . . . . 0.0 110.162 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.7 -48.38 42.97 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 -99.86 132.14 45.4 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.405 -1.056 . . . . 0.0 110.013 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.492 HG23 ' H ' ' A' ' 80' ' ' GLY . 0.0 OUTLIER -145.37 -92.42 0.1 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.383 -0.823 . . . . 0.0 110.069 -179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.492 ' H ' HG23 ' A' ' 79' ' ' THR . . . -91.81 4.88 79.25 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.882 -1.287 . . . . 0.0 109.882 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.75 ' O ' HD12 ' A' ' 81' ' ' LEU . 0.3 OUTLIER -170.31 154.0 4.67 Favored Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.191 -1.182 . . . . 0.0 109.015 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.4 63.86 5.44 Favored 'Trans proline' 0 C--N 1.302 -1.881 0 O-C-N 123.535 1.282 . . . . 0.0 110.379 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -53.49 102.8 0.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.458 -0.776 . . . . 0.0 110.423 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.51 -25.27 13.97 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.844 . . . . 0.0 110.23 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.2 t -58.58 -25.46 62.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.339 -0.85 . . . . 0.0 110.295 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.1 p -95.5 -24.06 16.82 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.378 -0.827 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 21.7 mtt -76.15 125.15 28.62 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.347 -0.845 . . . . 0.0 110.176 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.9 p -77.92 -163.81 0.45 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.422 -0.799 . . . . 0.0 110.281 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.563 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.3 pt-20 -67.24 -31.97 72.69 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.538 -0.726 . . . . 0.0 109.268 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.443 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.6 mt-10 -85.43 -40.07 16.84 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.01 -42.73 97.05 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -69.57 -34.9 74.83 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.67 -37.15 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.879 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.79 -34.87 79.15 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -77.82 -44.59 26.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.565 -0.709 . . . . 0.0 109.926 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.86 -33.38 72.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.369 -0.832 . . . . 0.0 110.065 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.9 tpp -80.58 -21.91 41.21 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.848 . . . . 0.0 109.801 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -73.09 -38.9 66.22 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.459 -0.775 . . . . 0.0 110.028 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 92.6 mtp -84.55 -18.31 36.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.376 -0.828 . . . . 0.0 110.389 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.73 -24.8 22.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.203 -0.935 . . . . 0.0 110.277 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 tp -95.37 14.07 23.7 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.586 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.3 -26.15 38.99 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.94 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 168.83 83.93 0.05 OUTLIER Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.85 80.63 3.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -1.087 . . . . 0.0 110.176 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.61 -62.25 2.0 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.839 . . . . 0.0 110.283 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -141.25 -68.16 0.4 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.396 -0.815 . . . . 0.0 110.18 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 104.1 -33.27 6.71 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -118.8 86.23 2.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.352 -1.087 . . . . 0.0 110.143 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -162.9 89.11 0.63 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.4 -0.813 . . . . 0.0 110.226 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -127.4 -60.35 1.19 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.431 -0.793 . . . . 0.0 110.185 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.5 t -77.29 -68.91 0.57 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.399 -0.813 . . . . 0.0 110.228 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.177 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.443 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.9 ttp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.131 0.491 . . . . 0.0 110.38 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -89.98 139.87 30.19 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.335 -0.853 . . . . 0.0 109.779 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 21.9 pt -137.56 159.64 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.235 -0.915 . . . . 0.0 110.353 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -111.92 143.54 42.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.713 -0.617 . . . . 0.0 110.517 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 65.0 t -128.02 121.07 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.321 -0.862 . . . . 0.0 109.854 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 4.0 mtpt -99.98 128.13 46.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.181 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.7 p -95.9 177.27 5.82 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.485 -0.759 . . . . 0.0 110.506 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.489 HD21 HG22 ' B' ' 70' ' ' VAL . 4.6 mm? -61.35 -14.46 27.46 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.557 -0.714 . . . . 0.0 110.956 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.7 p -95.61 17.74 14.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.154 -0.966 . . . . 0.0 110.683 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.12 11.06 58.11 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 6.2 tmtm? -85.0 132.63 34.31 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.08 -1.247 . . . . 0.0 109.816 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -113.19 125.19 54.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.396 -0.815 . . . . 0.0 110.273 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.7 mt -109.31 135.4 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 110.405 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.3 m -102.32 118.48 36.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.474 -0.766 . . . . 0.0 109.194 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -123.5 164.22 19.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.229 -0.92 . . . . 0.0 110.916 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -106.38 116.99 32.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.495 -0.753 . . . . 0.0 109.423 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.459 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.7 m -140.17 174.98 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.841 . . . . 0.0 110.746 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -113.1 165.81 12.43 Favored Pre-proline 0 N--CA 1.488 1.444 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -72.69 -26.13 16.53 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 123.617 1.325 . . . . 0.0 110.398 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.51 -4.0 58.71 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.057 -1.027 . . . . 0.0 110.508 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -71.22 138.84 49.82 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.132 -0.98 . . . . 0.0 110.54 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 68.0 p -83.37 160.24 21.67 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.482 -0.761 . . . . 0.0 110.248 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.705 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.22 -28.98 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.664 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.93 -40.51 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 109.38 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -70.14 -31.36 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.544 -0.722 . . . . 0.0 109.483 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 81.8 t -70.16 -40.97 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.773 . . . . 0.0 109.27 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 9.9 mttp -62.99 -42.98 99.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.406 -0.809 . . . . 0.0 109.238 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -34.29 75.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.47 -0.769 . . . . 0.0 109.475 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.459 ' CD ' HG12 ' B' ' 17' ' ' VAL . 21.9 mttp -68.03 -39.97 83.0 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.524 -0.735 . . . . 0.0 109.674 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.506 HD13 HD22 ' B' ' 69' ' ' LEU . 18.7 mt -67.15 -37.68 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.331 -0.856 . . . . 0.0 109.071 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -52.08 66.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.813 . . . . 0.0 109.68 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -58.13 -27.63 63.93 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.451 -0.781 . . . . 0.0 110.643 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.03 -38.2 21.18 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.164 -0.96 . . . . 0.0 110.854 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -108.07 -56.43 2.24 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.226 -0.921 . . . . 0.0 110.502 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.15 17.64 1.98 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.499 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.9 mt -91.44 143.59 28.39 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.076 -1.249 . . . . 0.0 109.785 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.499 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -67.66 133.44 29.72 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.65 1.342 . . . . 0.0 110.415 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.69 -26.7 83.47 Favored 'Trans proline' 0 C--N 1.312 -1.346 0 O-C-N 123.732 1.386 . . . . 0.0 110.849 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -24.89 64.37 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.357 -0.84 . . . . 0.0 109.956 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.418 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.1 mt-30 -101.31 3.11 40.4 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.348 -0.845 . . . . 0.0 110.465 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -94.17 137.65 33.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.124 -0.985 . . . . 0.0 110.327 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -130.06 129.52 43.73 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.429 -0.794 . . . . 0.0 109.863 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.793 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.9 mt -104.45 116.89 32.9 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.418 -0.801 . . . . 0.0 110.397 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.793 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.37 135.36 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.482 -0.761 . . . . 0.0 109.675 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.483 ' HB2' HD23 ' B' ' 67' ' ' LEU . 44.0 t80 -141.12 154.06 45.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.447 -0.783 . . . . 0.0 109.981 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 26.73 0.26 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.481 -0.762 . . . . 0.0 111.329 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.99 -3.74 74.54 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.159 -1.02 . . . . 0.0 110.621 179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 136.93 49.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.976 -1.308 . . . . 0.0 110.31 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.29 134.92 37.45 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.21 -0.931 . . . . 0.0 109.832 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.665 HD22 ' CG ' ' B' ' 59' ' ' TYR . 26.7 mt -83.96 144.77 28.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . 0.403 ' HB2' ' CG ' ' B' ' 54' ' ' ARG . 56.0 mm-40 -93.65 130.59 39.52 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.378 -0.826 . . . . 0.0 110.433 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.426 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.4 p30 -48.58 -26.83 2.41 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.522 -0.736 . . . . 0.0 111.435 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.64 -5.16 89.72 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.403 ' CG ' ' HB2' ' B' ' 51' ' ' GLU . 13.5 mmt180 -99.6 157.91 16.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.076 -1.249 . . . . 0.0 110.45 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 65.2 p -102.63 161.5 13.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.389 -0.82 . . . . 0.0 110.212 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.546 HD22 HG21 ' B' ' 61' ' ' ILE . 68.7 mt -53.63 -47.34 70.36 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.389 -0.819 . . . . 0.0 110.626 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.8 t -56.74 -37.0 70.4 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.432 -0.793 . . . . 0.0 111.17 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.33 -26.62 65.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.147 -0.971 . . . . 0.0 110.24 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.665 ' CG ' HD22 ' B' ' 50' ' ' LEU . 25.3 m-85 -101.04 27.16 6.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.379 -0.826 . . . . 0.0 109.829 179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.64 28.01 3.27 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.444 -0.785 . . . . 0.0 110.688 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.546 HG21 HD22 ' B' ' 56' ' ' LEU . 88.8 mt -81.56 112.01 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.362 -0.836 . . . . 0.0 109.973 179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -105.66 171.7 7.19 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 64' ' ' GLU . 0.9 OUTLIER -46.62 157.18 0.15 Allowed 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.514 -0.741 . . . . 0.0 111.268 -179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' B' ' 64' ' ' GLU . 0.0 OUTLIER 63.81 8.36 3.76 Favored 'General case' 0 C--N 1.299 -1.608 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.791 177.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -71.54 142.36 50.09 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.018 -1.051 . . . . 0.0 110.153 179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 23.4 m -107.77 113.51 26.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.36 -0.837 . . . . 0.0 109.973 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.483 HD23 ' HB2' ' B' ' 45' ' ' PHE . 1.7 mt -102.18 164.18 11.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.33 -0.856 . . . . 0.0 110.048 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -108.58 128.87 55.21 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.32 -0.863 . . . . 0.0 109.959 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.506 HD22 HD13 ' B' ' 30' ' ' ILE . 48.0 tp -107.02 132.71 52.64 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.255 -0.903 . . . . 0.0 110.277 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.489 HG22 HD21 ' B' ' 8' ' ' LEU . 41.5 t -124.67 152.76 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.375 -0.828 . . . . 0.0 110.181 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.2 mt -94.53 107.71 19.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.397 -0.814 . . . . 0.0 110.247 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -77.56 131.87 38.06 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.314 -0.866 . . . . 0.0 110.13 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 97.2 mt -94.08 178.95 5.48 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.427 -0.795 . . . . 0.0 110.278 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.29 103.63 8.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.366 -0.834 . . . . 0.0 110.138 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.75 73.1 0.47 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 CA-C-O 117.97 -1.461 . . . . 0.0 109.54 -179.968 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.161 0.505 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.2 mtp -68.35 -176.57 0.77 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.357 -0.839 . . . . 0.0 110.14 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.0 tp -111.28 26.08 11.05 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.514 -0.742 . . . . 0.0 109.411 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -99.31 67.6 0.61 Allowed Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 33.0 mt -60.49 -24.92 65.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.312 -1.111 . . . . 0.0 110.218 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -85.53 59.01 4.85 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.16 -54.99 0.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.364 -1.08 . . . . 0.0 110.182 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.5 t -86.17 -13.65 46.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.877 . . . . 0.0 110.503 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -59.37 -19.52 47.47 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.302 -0.874 . . . . 0.0 110.428 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.448 ' O ' ' CD2' ' A' ' 10' ' ' PHE . 34.0 p90 -149.22 116.36 6.05 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.195 -0.941 . . . . 0.0 110.209 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -113.97 65.76 0.66 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.308 -0.87 . . . . 0.0 110.029 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 53.74 23.78 3.94 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.317 -0.864 . . . . 0.0 110.536 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -123.2 28.65 5.52 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 -51.4 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.425 -1.044 . . . . 0.0 109.982 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -122.11 164.05 28.0 Favored Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.489 -0.757 . . . . 0.0 109.416 179.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.827 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 34.8 Cg_endo -57.38 76.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.877 1.461 . . . . 0.0 111.793 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.506 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.2 OUTLIER 67.79 40.86 2.31 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.556 0.694 . . . . 0.0 109.924 179.391 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.458 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 41.99 31.61 0.24 Allowed 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.165 0.507 . . . . 0.0 110.936 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -164.72 116.9 0.94 Allowed Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -71.26 -14.24 31.3 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.049 1.552 . . . . 0.0 109.894 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.96 -31.94 64.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.413 -0.804 . . . . 0.0 109.116 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.6 tp -84.34 -31.22 24.93 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.827 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -65.04 -34.85 79.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.583 -0.698 . . . . 0.0 109.32 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.612 ' O ' HG23 ' A' ' 28' ' ' VAL . 15.6 tp -82.34 -32.5 29.3 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.603 -0.685 . . . . 0.0 109.803 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.24 -39.69 89.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.299 -0.875 . . . . 0.0 109.864 179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.554 HD11 ' O ' ' B' ' 47' ' ' GLY . 1.9 tp -83.04 -22.13 33.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.356 -0.84 . . . . 0.0 110.331 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.5 ttt-85 -79.27 -32.28 43.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.263 -0.898 . . . . 0.0 108.583 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 24' ' ' LEU . 63.1 t -84.45 -28.58 6.95 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.405 ' HB3' ' N ' ' B' ' 47' ' ' GLY . 0.4 OUTLIER -69.67 -46.14 66.77 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.558 -0.714 . . . . 0.0 109.853 179.501 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -68.84 -41.56 78.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.453 -0.779 . . . . 0.0 109.983 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -60.19 -39.14 85.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.419 -0.801 . . . . 0.0 110.028 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -38.59 88.54 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.469 -0.769 . . . . 0.0 109.863 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -62.35 -39.35 92.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.828 . . . . 0.0 110.008 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -38.09 89.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.37 -0.831 . . . . 0.0 109.896 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -33.54 75.71 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.377 -0.827 . . . . 0.0 109.853 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -40.53 18.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.414 -0.804 . . . . 0.0 109.975 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.535 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 7.7 mm-40 -71.49 -23.26 61.77 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.419 -0.8 . . . . 0.0 110.094 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -83.86 -58.11 2.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.48 179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.76 -30.16 43.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.445 -0.784 . . . . 0.0 109.103 179.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -84.91 -39.14 18.55 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.758 -0.589 . . . . 0.0 109.506 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.02 -54.62 17.08 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.897 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.6 mtt-85 -59.92 -35.81 75.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.413 -0.804 . . . . 0.0 110.213 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -58.54 -39.16 79.42 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.211 -0.931 . . . . 0.0 109.96 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.83 -29.37 44.67 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.441 -0.787 . . . . 0.0 109.938 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.54 -30.21 62.93 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.461 -0.774 . . . . 0.0 110.04 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.52 -45.04 22.87 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.452 -0.78 . . . . 0.0 110.072 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.53 93.15 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.361 -0.837 . . . . 0.0 110.061 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 48.0 t -73.67 -43.25 59.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.424 -0.797 . . . . 0.0 110.061 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.75 -44.58 95.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 110.052 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.3 -26.86 68.24 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.505 -0.747 . . . . 0.0 110.134 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.52 21.75 16.19 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.387 -0.821 . . . . 0.0 110.195 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -143.68 -45.4 0.28 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 110.015 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.58 -44.93 38.54 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.597 HG23 ' O ' ' A' ' 54' ' ' ILE . 5.6 tp -115.2 73.31 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.468 -1.019 . . . . 0.0 110.051 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.73 -151.18 0.08 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.335 -0.853 . . . . 0.0 110.059 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 12.9 p -52.62 145.14 12.41 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.205 -0.934 . . . . 0.0 110.44 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.5 m -73.78 -63.09 1.28 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.335 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.59 -99.81 0.14 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.674 -1.371 . . . . 0.0 109.674 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.6 m -124.32 100.24 6.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.374 -1.074 . . . . 0.0 110.273 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -167.56 102.93 0.5 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.304 -0.873 . . . . 0.0 110.106 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -146.37 -62.6 0.31 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 110.39 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.531 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 28.1 m -133.63 85.31 2.19 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.309 -0.869 . . . . 0.0 110.431 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -63.29 -33.63 75.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.327 -0.858 . . . . 0.0 110.095 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -75.31 -28.44 59.68 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.234 -0.916 . . . . 0.0 109.191 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -62.66 -36.19 82.06 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.692 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -31.58 68.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.64 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -74.58 -42.58 58.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.479 -0.763 . . . . 0.0 109.511 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.2 OUTLIER -78.42 -53.06 7.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.471 -0.768 . . . . 0.0 110.321 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 ttp -53.55 -40.99 66.01 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.204 -0.935 . . . . 0.0 110.524 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 24.2 m -64.78 -47.38 78.34 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.305 -0.872 . . . . 0.0 110.321 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.441 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.6 tp -82.45 -11.69 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.261 -0.9 . . . . 0.0 110.391 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 31.8 t -72.9 -46.85 50.48 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -0.89 . . . . 0.0 109.8 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -81.85 -26.28 34.39 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.4 -0.812 . . . . 0.0 109.908 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.04 -27.22 39.46 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.318 -0.864 . . . . 0.0 110.245 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -85.74 -49.23 8.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -48.35 79.52 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.393 -0.817 . . . . 0.0 110.165 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.01 -49.14 78.2 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.91 110.0 22.13 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.383 -1.069 . . . . 0.0 110.07 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -130.38 49.61 2.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.398 -0.814 . . . . 0.0 110.25 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.02 34.84 5.3 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -173.32 150.56 1.88 Allowed Pre-proline 0 N--CA 1.488 1.433 0 O-C-N 121.377 -1.072 . . . . 0.0 108.924 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -76.25 39.84 0.71 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 123.52 1.274 . . . . 0.0 110.8 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 50.78 56.41 8.03 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.139 -0.976 . . . . 0.0 110.62 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.4 -24.07 67.68 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.289 -0.882 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 58.7 m -59.73 -19.49 50.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.327 -0.858 . . . . 0.0 110.515 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.1 t -98.14 -8.8 26.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.218 -0.926 . . . . 0.0 110.504 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.47 121.9 37.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.266 -0.896 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 66.4 p -77.66 -162.2 0.3 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.365 -0.834 . . . . 0.0 110.376 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.549 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 pt-20 -69.39 -31.08 69.23 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.484 -0.76 . . . . 0.0 109.114 179.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.456 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.6 OUTLIER -85.27 -39.54 17.62 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -63.92 -46.08 86.39 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -65.63 -34.22 77.73 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.549 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.2 -33.65 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.71 90.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.506 -0.746 . . . . 0.0 109.722 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -44.56 93.29 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.419 -0.801 . . . . 0.0 110.051 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.67 -31.1 61.81 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.863 . . . . 0.0 110.361 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.0 tpt -83.42 -24.97 31.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.367 -0.833 . . . . 0.0 110.023 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.23 -38.29 63.58 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.285 -0.885 . . . . 0.0 110.081 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.7 mtm -81.26 -23.76 37.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.318 -0.864 . . . . 0.0 110.243 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.9 m -80.22 -29.15 38.5 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' A' ' 101' ' ' LEU . 2.3 mm? -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.307 -0.871 . . . . 0.0 110.454 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.81 -35.08 4.92 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.109 -0.994 . . . . 0.0 110.2 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -80.76 -46.82 7.01 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -110.06 67.99 0.66 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.413 -1.051 . . . . 0.0 110.161 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.88 -22.55 62.27 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.793 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -95.26 39.73 1.11 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.266 -0.896 . . . . 0.0 110.3 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -119.95 44.75 1.33 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -106.23 52.86 0.72 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.256 -1.144 . . . . 0.0 110.246 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.38 -50.11 0.15 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.273 -0.892 . . . . 0.0 110.194 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -89.14 84.26 6.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.386 -0.821 . . . . 0.0 110.182 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -145.31 -49.54 0.24 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.372 -0.83 . . . . 0.0 110.217 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.19 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.342 0.592 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -103.07 147.03 27.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.422 -0.799 . . . . 0.0 110.109 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.703 HD13 HG21 ' B' ' 17' ' ' VAL . 38.3 pt -137.52 158.28 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -111.99 143.84 42.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.598 -0.689 . . . . 0.0 110.613 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 63.8 t -127.89 120.75 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.46 -0.775 . . . . 0.0 109.491 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.1 mtpt -100.03 129.81 46.12 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.409 -0.807 . . . . 0.0 110.568 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.573 HG22 HD23 ' B' ' 69' ' ' LEU . 32.2 p -95.81 175.98 6.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.401 -0.812 . . . . 0.0 110.283 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.442 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.16 -15.97 39.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.794 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.4 p -95.96 20.45 10.03 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.097 -1.002 . . . . 0.0 110.765 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.87 13.78 59.86 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.5 tttp -84.76 130.09 34.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.051 -1.264 . . . . 0.0 109.768 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 10.1 m -113.05 124.96 53.83 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.143 -0.973 . . . . 0.0 110.439 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 6.5 mt -109.32 133.23 55.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.409 -0.807 . . . . 0.0 110.259 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.7 m -102.38 118.76 37.55 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.371 -0.831 . . . . 0.0 109.564 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 67.9 mt -123.42 168.69 12.22 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.218 -0.926 . . . . 0.0 110.792 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -106.61 116.03 31.22 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.399 -0.813 . . . . 0.0 109.642 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.703 HG21 HD13 ' B' ' 3' ' ' ILE . 35.0 m -140.43 169.77 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.257 -0.902 . . . . 0.0 110.696 -179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.509 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.1 mp0 -112.62 166.07 11.77 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.57 -0.706 . . . . 0.0 109.294 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.16 -25.63 18.82 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 123.538 1.283 . . . . 0.0 110.313 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -84.33 -3.56 58.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.212 -0.93 . . . . 0.0 110.506 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -71.21 141.41 50.63 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.178 -0.951 . . . . 0.0 110.465 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 46.4 p -83.17 157.13 22.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.54 -0.725 . . . . 0.0 110.367 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.503 HG23 HD12 ' B' ' 43' ' ' LEU . 43.0 mm -59.55 -35.3 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.292 -0.88 . . . . 0.0 109.435 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.16 -37.26 79.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.458 -0.776 . . . . 0.0 109.276 179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -70.32 -30.15 67.06 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.553 -0.717 . . . . 0.0 109.296 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 22' ' ' THR . 60.2 t -70.54 -41.44 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.468 -0.77 . . . . 0.0 109.16 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -62.85 -43.82 97.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.403 -0.81 . . . . 0.0 109.151 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -31.71 71.61 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.533 -0.73 . . . . 0.0 109.289 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.451 ' HE2' HG12 ' B' ' 17' ' ' VAL . 13.4 mttp -68.35 -40.36 81.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.556 -0.715 . . . . 0.0 109.363 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.8 mt -67.09 -37.56 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.024 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 54.9 tt0 -60.78 -51.76 67.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.376 -0.827 . . . . 0.0 109.631 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.15 -27.1 63.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.433 -0.792 . . . . 0.0 110.592 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.93 -41.72 17.07 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.294 -0.879 . . . . 0.0 110.865 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 47.1 mm-40 -108.13 -53.72 2.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.217 -0.927 . . . . 0.0 110.427 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.5 19.74 2.04 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.151 -1.18 . . . . 0.0 110.151 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.489 HG23 ' HD2' ' B' ' 37' ' ' PRO . 51.8 mt -91.39 143.42 28.18 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.108 -1.231 . . . . 0.0 109.823 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -69.69 133.04 24.74 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.663 1.349 . . . . 0.0 110.437 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.84 -25.78 81.86 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 O-C-N 123.705 1.371 . . . . 0.0 110.845 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -68.78 -25.2 64.58 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.304 -0.873 . . . . 0.0 109.88 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 29.5 mm-40 -101.33 5.16 42.19 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.433 -0.792 . . . . 0.0 110.46 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . 0.429 ' HG2' HD11 ' B' ' 69' ' ' LEU . 7.9 mt-30 -94.26 141.82 28.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.227 -0.921 . . . . 0.0 110.425 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.12 124.46 32.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.447 -0.783 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 28.1 mt -104.6 118.19 35.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.217 -0.927 . . . . 0.0 110.274 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.8 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -120.89 133.04 68.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.571 -0.706 . . . . 0.0 109.714 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.527 ' HB2' HD23 ' B' ' 67' ' ' LEU . 29.1 t80 -140.87 147.21 38.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.429 -0.794 . . . . 0.0 110.064 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.27 28.79 0.47 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.483 -0.76 . . . . 0.0 111.191 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.554 ' O ' HD11 ' A' ' 26' ' ' LEU . . . 78.49 2.91 85.72 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -111.13 134.79 52.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.045 -1.268 . . . . 0.0 110.243 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -78.46 134.46 37.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.316 -0.865 . . . . 0.0 109.406 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.7 HD12 ' HB3' ' B' ' 43' ' ' LEU . 35.0 mt -83.88 137.07 33.85 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.239 -0.913 . . . . 0.0 110.361 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -93.76 130.64 39.67 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.435 -0.791 . . . . 0.0 110.41 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.461 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.39 -26.87 2.28 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.494 -0.754 . . . . 0.0 111.211 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.81 86.69 Favored Glycine 0 N--CA 1.494 2.547 0 C-N-CA 120.046 -1.073 . . . . 0.0 110.608 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -99.42 156.28 17.1 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.045 -1.268 . . . . 0.0 110.483 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.6 p -102.42 163.84 12.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.373 -0.829 . . . . 0.0 110.158 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.509 HD12 ' O ' ' B' ' 18' ' ' GLU . 85.6 mt -53.5 -44.47 69.11 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.313 -0.867 . . . . 0.0 110.465 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 27.4 p -56.86 -36.31 69.9 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.398 -0.814 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.59 -27.96 66.73 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.099 -1.001 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.553 ' CD2' HD22 ' B' ' 50' ' ' LEU . 50.4 m-85 -101.13 27.54 6.03 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 109.93 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 50.6 28.2 3.34 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.604 -0.685 . . . . 0.0 110.683 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.485 HD12 ' HA ' ' B' ' 56' ' ' LEU . 90.9 mt -81.54 108.87 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.93 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.58 174.68 5.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.344 -0.847 . . . . 0.0 110.065 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.56 153.37 0.38 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.465 -0.772 . . . . 0.0 111.022 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 7.6 mt-10 62.64 16.32 8.77 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.667 -0.645 . . . . 0.0 110.681 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.55 142.05 50.08 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.191 -0.943 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 20.3 m -107.64 109.93 21.67 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.334 -0.854 . . . . 0.0 110.115 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.527 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.2 mt -102.54 160.72 14.31 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.84 . . . . 0.0 110.101 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -108.83 132.66 53.79 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.306 -0.871 . . . . 0.0 110.043 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.573 HD23 HG22 ' B' ' 7' ' ' THR . 54.7 tp -107.28 129.38 54.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.305 -0.872 . . . . 0.0 110.184 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 47.6 t -125.01 157.64 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.46 -0.775 . . . . 0.0 110.071 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -94.13 162.94 13.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.357 -0.839 . . . . 0.0 110.122 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -147.26 100.16 3.24 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.255 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mp -105.82 114.61 28.87 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.315 -0.865 . . . . 0.0 110.233 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -63.68 179.35 0.49 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.349 -0.844 . . . . 0.0 110.203 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 135.16 -36.92 1.99 Allowed Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 CA-C-O 117.905 -1.497 . . . . 0.0 109.552 179.998 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.0 t60 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 121.232 0.539 . . . . 0.0 110.186 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -167.36 -172.22 1.91 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.421 -0.799 . . . . 0.0 110.086 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt -113.44 26.57 10.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.441 -0.787 . . . . 0.0 109.643 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.59 64.9 1.42 Allowed Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.512 ' O ' HD12 ' A' ' 5' ' ' LEU . 0.9 OUTLIER -160.74 70.33 0.39 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.329 -1.101 . . . . 0.0 110.303 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -126.16 137.58 10.23 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -91.6 72.15 5.9 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -1.099 . . . . 0.0 110.16 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.6 p -148.94 -45.09 0.14 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.345 -0.847 . . . . 0.0 110.184 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.39 -34.98 68.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.395 -0.815 . . . . 0.0 110.151 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.437 ' HA ' HG13 ' A' ' 14' ' ' VAL . 29.8 m-85 -97.89 14.58 26.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.334 -0.854 . . . . 0.0 110.426 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -76.57 82.79 3.24 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 109.861 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 52.75 42.42 31.77 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.405 -0.809 . . . . 0.0 110.359 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -138.96 20.92 3.02 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.437 HG13 ' HA ' ' A' ' 10' ' ' PHE . 34.8 m -120.46 -31.85 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.2 -1.176 . . . . 0.0 110.374 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.499 ' CG ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -123.36 163.48 33.87 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.602 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 34.2 Cg_endo -56.8 76.11 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.956 1.503 . . . . 0.0 112.095 -178.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.499 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.1 t 67.88 36.51 3.43 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-O 121.541 0.686 . . . . 0.0 110.231 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.462 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 44.78 25.4 0.14 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.071 0.462 . . . . 0.0 111.153 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.94 117.44 0.52 Allowed Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.116 -0.99 . . . . 0.0 110.166 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -71.27 -14.17 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.012 1.533 . . . . 0.0 110.095 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -75.27 -32.67 61.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.38 -0.825 . . . . 0.0 109.322 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -83.77 -29.48 27.39 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.602 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -74.08 -36.08 64.28 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.592 -0.693 . . . . 0.0 109.447 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.73 ' O ' HG23 ' A' ' 28' ' ' VAL . 41.9 tp -78.7 -34.89 45.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.581 -0.7 . . . . 0.0 109.69 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.82 -35.81 81.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.394 -0.816 . . . . 0.0 109.92 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.437 HD21 ' HA3' ' B' ' 47' ' ' GLY . 0.6 OUTLIER -78.83 -23.14 45.23 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.486 -0.759 . . . . 0.0 110.207 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -27.46 38.78 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.285 -0.885 . . . . 0.0 109.333 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 24' ' ' LEU . 57.7 t -80.79 -27.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 O-C-N 121.558 -0.714 . . . . 0.0 109.757 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.4 m -78.54 -31.76 47.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.386 -0.821 . . . . 0.0 110.036 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.55 -34.33 47.16 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.432 -0.793 . . . . 0.0 110.017 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.17 -32.73 63.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 110.068 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -73.74 -39.72 64.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -0.846 . . . . 0.0 110.25 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -64.53 -41.82 96.13 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.366 -0.834 . . . . 0.0 110.15 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.01 -39.99 90.71 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.301 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.86 -44.78 86.81 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.374 -0.828 . . . . 0.0 110.208 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -77.27 -43.28 33.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.361 -0.837 . . . . 0.0 110.123 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.684 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.7 mm100 -66.14 -28.21 68.62 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.828 . . . . 0.0 110.211 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -83.98 -57.89 3.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.449 -0.782 . . . . 0.0 109.777 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -52.06 -34.28 42.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.426 -0.796 . . . . 0.0 109.347 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.41 -34.1 28.39 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.684 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.58 -49.43 71.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.431 -0.793 . . . . 0.0 109.828 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.22 -32.22 64.62 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.451 -0.781 . . . . 0.0 109.894 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -53.79 -36.43 62.43 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.214 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.1 -27.22 35.69 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.546 -0.721 . . . . 0.0 109.126 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.03 -29.5 69.33 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.553 -0.717 . . . . 0.0 109.843 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.91 -38.02 13.99 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.451 -0.78 . . . . 0.0 110.014 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.94 -36.95 70.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.784 . . . . 0.0 110.077 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -37.63 47.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.44 -0.787 . . . . 0.0 109.975 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.68 -29.13 70.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.823 . . . . 0.0 110.073 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.44 -21.83 57.83 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.452 -0.78 . . . . 0.0 110.293 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -76.59 -62.6 1.57 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.261 -0.9 . . . . 0.0 110.237 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -119.78 36.94 4.34 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.408 -0.808 . . . . 0.0 110.359 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -129.43 -60.93 0.1 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.513 ' O ' HG22 ' A' ' 54' ' ' ILE . 37.5 mm -90.4 73.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -1.045 . . . . 0.0 110.096 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -167.91 63.2 0.07 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.324 -0.86 . . . . 0.0 110.188 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.41 133.36 37.52 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.341 -0.85 . . . . 0.0 110.077 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 24.7 m -132.51 120.7 22.24 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.31 43.28 0.4 Allowed Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -115.03 53.07 0.83 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -1.136 . . . . 0.0 110.19 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.54 56.86 1.15 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.267 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -62.27 -63.36 1.26 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.277 -0.889 . . . . 0.0 110.131 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.435 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 1.5 m -84.81 78.81 9.81 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.351 -0.843 . . . . 0.0 110.049 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -72.39 -61.87 1.64 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.336 -0.852 . . . . 0.0 110.35 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -77.67 -28.67 51.2 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.183 -0.948 . . . . 0.0 109.517 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.435 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -63.54 -35.26 79.89 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.414 -0.915 . . . . 0.0 108.786 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.432 ' O ' HG22 ' A' ' 70' ' ' THR . 14.1 tp -73.04 -30.94 64.11 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -77.55 -34.35 53.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.595 -0.69 . . . . 0.0 109.669 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.47 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -84.63 -51.29 6.95 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 109.926 179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.1 ttt -53.33 -38.62 63.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.275 -0.891 . . . . 0.0 110.425 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 66' ' ' LEU . 14.4 t -74.59 -36.27 63.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.243 -0.911 . . . . 0.0 110.474 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.47 HG22 ' HA ' ' A' ' 68' ' ' LYS . 3.4 tp -85.45 -14.01 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.387 -0.821 . . . . 0.0 110.323 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.406 ' N ' ' O ' ' A' ' 68' ' ' LYS . 35.5 t -83.82 -33.41 24.93 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.926 . . . . 0.0 109.992 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -91.86 -24.31 19.38 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.299 -0.876 . . . . 0.0 110.185 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -32.9 10.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.32 -0.863 . . . . 0.0 110.232 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.462 ' C ' ' CG ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -110.5 -12.97 14.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.366 -0.834 . . . . 0.0 110.607 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.462 ' CG ' ' C ' ' A' ' 75' ' ' GLU . 13.9 p90 31.49 57.89 0.29 Allowed 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.567 -0.708 . . . . 0.0 111.769 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.51 -63.73 3.12 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.297 -1.521 . . . . 0.0 109.297 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -43.01 6.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.411 -1.053 . . . . 0.0 110.016 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.67 HG22 ' O ' ' A' ' 79' ' ' THR . 67.1 m 51.73 26.07 3.25 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.343 -0.848 . . . . 0.0 110.022 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 94.01 -89.42 1.27 Allowed Glycine 0 N--CA 1.489 2.228 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.587 HD23 ' HD2' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -178.18 146.87 0.57 Allowed Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.529 -0.983 . . . . 0.0 109.154 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.587 ' HD2' HD23 ' A' ' 81' ' ' LEU . 46.6 Cg_endo -73.49 50.68 2.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.517 1.272 . . . . 0.0 110.523 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -73.32 84.74 1.43 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.244 -0.91 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.82 -28.79 63.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.374 -0.829 . . . . 0.0 110.201 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.8 m -59.2 -24.63 63.28 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.347 -0.845 . . . . 0.0 110.58 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.7 t -99.85 -25.17 14.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.34 -0.85 . . . . 0.0 110.447 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 22.5 mtt -75.16 120.41 20.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -0.885 . . . . 0.0 110.161 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.489 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 77.4 p -74.0 -158.07 0.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.498 -0.751 . . . . 0.0 110.426 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.58 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 2.8 mt-10 -73.53 -29.85 62.72 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.559 -0.713 . . . . 0.0 109.077 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.44 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 31.7 mt-10 -85.09 -36.97 20.81 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.489 ' HB2' ' N ' ' A' ' 88' ' ' THR . 7.8 mm-40 -66.19 -45.27 81.42 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 178.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -66.47 -34.79 78.73 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.58 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -65.61 -36.24 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 178.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.41 71.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.494 -0.754 . . . . 0.0 109.613 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -84.52 -46.13 11.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.462 -0.774 . . . . 0.0 110.19 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.44 -30.92 67.89 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.417 -0.802 . . . . 0.0 110.505 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 13.4 ttm -82.3 -25.52 33.9 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.285 -0.884 . . . . 0.0 109.971 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.06 -33.13 65.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.402 -0.811 . . . . 0.0 110.147 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 4.9 mtt -87.33 -25.87 23.67 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.465 -0.772 . . . . 0.0 110.316 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.4 t -76.49 -43.32 40.11 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.361 -0.837 . . . . 0.0 110.548 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 101' ' ' LEU . 2.5 mm? -68.03 -32.38 72.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.343 -0.848 . . . . 0.0 110.338 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -60.97 -66.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.409 -0.807 . . . . 0.0 110.309 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 156.47 -117.94 0.81 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -169.28 79.98 0.12 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.344 -1.092 . . . . 0.0 110.161 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -86.67 74.82 9.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.346 -0.846 . . . . 0.0 110.207 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -164.28 -66.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.377 -0.827 . . . . 0.0 110.128 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -111.75 -171.14 18.86 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.98 69.36 1.2 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.301 -1.117 . . . . 0.0 110.279 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.16 -38.7 22.01 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.402 -0.811 . . . . 0.0 110.173 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -77.97 -38.09 45.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.395 -0.816 . . . . 0.0 110.148 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -81.48 121.11 25.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.382 -0.824 . . . . 0.0 110.046 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 179.982 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.137 0.494 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -93.24 140.71 29.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.359 -0.838 . . . . 0.0 109.797 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.8 pt -137.38 159.79 35.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.251 -0.906 . . . . 0.0 110.291 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -111.98 143.62 42.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.576 -0.703 . . . . 0.0 110.686 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 82.4 t -127.72 116.87 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.447 -0.783 . . . . 0.0 109.352 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.616 ' HG3' HG23 ' B' ' 12' ' ' THR . 13.4 mttt -100.18 131.87 45.87 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.345 -0.847 . . . . 0.0 110.813 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.433 HG22 HD23 ' B' ' 69' ' ' LEU . 17.5 p -95.99 173.34 7.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.878 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.402 HD11 HG13 ' B' ' 70' ' ' VAL . 8.6 mt -61.66 -12.01 14.31 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.343 -0.848 . . . . 0.0 110.941 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 63.8 p -95.65 16.06 18.31 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.036 -1.04 . . . . 0.0 110.767 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.36 8.59 66.46 Favored Glycine 0 N--CA 1.492 2.393 0 C-N-CA 120.195 -1.003 . . . . 0.0 110.629 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 11.6 tttt -84.75 127.27 34.03 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.052 -1.264 . . . . 0.0 109.905 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.616 HG23 ' HG3' ' B' ' 6' ' ' LYS . 3.5 m -113.24 126.84 55.85 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.977 . . . . 0.0 110.495 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 13.1 mt -109.46 136.67 44.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.358 -0.839 . . . . 0.0 110.439 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m -102.3 120.52 40.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.346 -0.846 . . . . 0.0 109.312 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.1 mt -123.49 162.22 23.31 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.117 -0.99 . . . . 0.0 110.857 -179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -106.55 116.15 31.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.475 -0.765 . . . . 0.0 109.664 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.24 176.45 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 110.787 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.408 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -113.14 163.24 18.62 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.689 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.44 -26.69 20.03 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.513 1.27 . . . . 0.0 110.276 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.5 m -84.54 -2.48 57.41 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.261 -0.9 . . . . 0.0 110.614 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -71.36 145.15 49.58 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.541 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.33 156.33 23.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.661 -0.65 . . . . 0.0 110.432 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.451 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.7 mm -59.61 -32.75 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.365 -0.834 . . . . 0.0 109.431 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -62.58 -36.74 83.66 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -70.21 -31.51 68.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.514 -0.742 . . . . 0.0 109.124 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.99 -40.37 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 mttt -62.92 -40.6 98.12 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -34.75 76.36 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 109.348 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.9 -39.99 83.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.571 -0.706 . . . . 0.0 109.554 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.0 mt -67.31 -37.62 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.152 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.4 tm0? -60.87 -53.33 58.62 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.469 -0.769 . . . . 0.0 109.833 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.1 -27.73 63.98 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.386 -0.821 . . . . 0.0 110.746 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -84.12 -36.52 22.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 111.167 -179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -108.07 -53.14 2.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.202 -0.936 . . . . 0.0 110.602 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.61 14.15 3.6 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.471 HG23 ' HD2' ' B' ' 37' ' ' PRO . 69.2 mt -91.37 143.25 27.94 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.107 -1.231 . . . . 0.0 109.874 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.544 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 38.7 Cg_endo -67.4 135.39 36.43 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.61 1.321 . . . . 0.0 110.391 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 -24.74 79.32 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.727 1.383 . . . . 0.0 111.001 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.73 -25.38 64.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.317 -0.865 . . . . 0.0 109.804 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.544 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.58 6.87 44.27 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.533 -0.73 . . . . 0.0 110.541 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -94.3 139.52 30.95 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.159 -0.963 . . . . 0.0 110.445 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.1 122.82 29.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.452 -0.78 . . . . 0.0 109.845 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.793 ' HB3' HD12 ' B' ' 50' ' ' LEU . 28.0 mt -104.7 116.69 32.47 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.481 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.786 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.12 133.78 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.553 -0.717 . . . . 0.0 109.658 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -140.39 151.64 45.11 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.458 -0.776 . . . . 0.0 109.807 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.38 28.14 0.44 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.472 -0.768 . . . . 0.0 111.048 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.437 ' HA3' HD21 ' A' ' 26' ' ' LEU . . . 77.52 2.31 79.72 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -111.13 138.3 47.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.083 -1.246 . . . . 0.0 110.292 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -78.39 135.88 37.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.9 . . . . 0.0 109.459 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.793 HD12 ' HB3' ' B' ' 43' ' ' LEU . 39.8 mt -83.79 138.45 33.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.37 -0.831 . . . . 0.0 110.315 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -93.67 127.76 39.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.387 -0.821 . . . . 0.0 110.6 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.451 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.33 -26.42 2.02 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.486 -0.759 . . . . 0.0 111.135 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -10.45 82.95 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.733 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.25 158.3 15.79 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.973 -1.31 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 41.3 p -102.39 166.15 10.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.768 . . . . 0.0 110.373 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.504 ' HA ' HD12 ' B' ' 61' ' ' ILE . 55.4 mt -53.64 -44.21 69.39 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.317 -0.864 . . . . 0.0 110.751 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 94.0 p -56.83 -36.77 70.36 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.342 -0.849 . . . . 0.0 111.153 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.55 -27.06 65.89 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.135 -0.978 . . . . 0.0 110.532 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.582 ' CD2' HD22 ' B' ' 50' ' ' LEU . 55.2 m-85 -101.06 24.72 8.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.286 -0.883 . . . . 0.0 110.221 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 50.69 30.33 4.86 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.4 -0.813 . . . . 0.0 110.723 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.528 HD13 HD21 ' B' ' 67' ' ' LEU . 73.5 mt -81.67 113.45 21.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.29 -0.881 . . . . 0.0 110.015 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.78 170.47 7.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.9 . . . . 0.0 110.262 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.74 153.28 0.41 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.568 -0.707 . . . . 0.0 111.103 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.84 16.1 8.8 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.611 -0.68 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.56 144.59 49.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.153 -0.967 . . . . 0.0 110.082 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.7 m -107.53 110.49 22.43 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.369 -0.832 . . . . 0.0 109.952 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.528 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.42 162.62 12.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.368 -0.832 . . . . 0.0 110.213 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.43 ' NE2' HG12 ' A' ' 28' ' ' VAL . 60.4 m80 -109.03 130.58 55.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.363 -0.835 . . . . 0.0 109.941 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.433 HD23 HG22 ' B' ' 7' ' ' THR . 55.0 tp -106.97 127.75 53.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.334 -0.854 . . . . 0.0 110.126 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.402 HG13 HD11 ' B' ' 8' ' ' LEU . 48.6 t -124.8 155.0 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.303 -0.873 . . . . 0.0 110.136 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.8 mt -94.18 128.12 40.42 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.442 -0.786 . . . . 0.0 110.25 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -86.16 70.95 10.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.357 -0.839 . . . . 0.0 110.15 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 76.5 mt -118.36 -176.94 3.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.36 -0.837 . . . . 0.0 110.347 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.67 131.33 3.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.376 -0.827 . . . . 0.0 110.015 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.39 114.36 0.06 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 CA-C-O 117.987 -1.452 . . . . 0.0 109.539 -179.908 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 39.2 m80 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.125 0.488 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.8 mtp -152.04 -174.09 4.75 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.458 -0.776 . . . . 0.0 110.14 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.52 23.87 13.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.489 -0.757 . . . . 0.0 109.482 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.86 50.32 3.14 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.45 35.29 2.9 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.323 -1.104 . . . . 0.0 110.225 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.2 105.12 0.3 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -80.58 60.79 4.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.387 -1.066 . . . . 0.0 110.147 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.0 t -152.28 -46.04 0.1 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.335 -0.853 . . . . 0.0 110.155 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -61.53 -41.13 96.87 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.379 -0.826 . . . . 0.0 110.159 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.444 ' O ' HG23 ' A' ' 14' ' ' VAL . 0.7 OUTLIER -108.42 63.78 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.456 -0.778 . . . . 0.0 110.06 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.99 136.42 36.6 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.36 -0.837 . . . . 0.0 110.347 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 53.18 24.35 3.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.284 -0.885 . . . . 0.0 110.568 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -137.59 28.36 2.76 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 10' ' ' PHE . 57.4 t -117.69 -33.83 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.365 -1.079 . . . . 0.0 110.122 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.556 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -138.63 -178.89 0.92 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.418 -0.801 . . . . 0.0 109.908 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.825 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.9 Cg_endo -61.13 78.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 123.536 1.282 . . . . 0.0 110.691 -178.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.455 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.1 m 69.04 46.32 0.83 Allowed 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 41.65 30.21 0.14 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.055 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -164.24 116.27 0.98 Allowed Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.238 -0.914 . . . . 0.0 110.544 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -72.62 -14.05 27.34 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.14 1.6 . . . . 0.0 109.656 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.435 ' HB3' ' CG1' ' B' ' 70' ' ' VAL . 31.5 mt-10 -72.67 -35.99 67.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.452 -0.78 . . . . 0.0 109.293 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.5 mt -79.47 -31.11 42.34 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.825 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -65.58 -33.41 75.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.554 -0.716 . . . . 0.0 109.105 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.454 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -82.59 -34.84 27.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.627 -0.671 . . . . 0.0 109.621 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.51 -34.19 67.44 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.391 -0.818 . . . . 0.0 109.724 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.466 HD23 ' HA2' ' B' ' 47' ' ' GLY . 26.6 mt -82.72 -21.04 34.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.284 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -77.3 -34.67 55.44 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.28 -0.888 . . . . 0.0 108.746 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.448 HG12 ' NE2' ' B' ' 68' ' ' HIS . 91.4 t -79.38 -24.76 12.52 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.742 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 p -73.28 -46.69 48.3 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.378 -0.826 . . . . 0.0 110.189 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -37.93 82.8 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.4 -0.813 . . . . 0.0 110.169 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.35 -29.28 67.05 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.432 -0.792 . . . . 0.0 110.098 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.66 -43.67 62.85 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.294 -0.879 . . . . 0.0 110.094 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -69.14 -33.13 72.95 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.328 -0.857 . . . . 0.0 110.057 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.7 -44.59 66.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.103 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.95 -29.23 69.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.361 -0.837 . . . . 0.0 110.332 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.5 mmt85 -86.85 -31.86 20.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.579 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.1 mt-30 -77.24 -27.67 53.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.406 -0.809 . . . . 0.0 110.112 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -84.05 -57.49 3.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.334 -0.854 . . . . 0.0 109.709 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -52.6 -30.97 34.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 109.377 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -87.0 -34.39 19.26 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.565 -0.709 . . . . 0.0 109.653 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.579 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -71.06 -54.22 11.91 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.22 -0.925 . . . . 0.0 109.982 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 17.3 mtt-85 -62.08 -48.14 81.54 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.391 -0.818 . . . . 0.0 110.165 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -54.1 -44.5 71.28 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.38 -29.98 60.02 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.387 -0.821 . . . . 0.0 109.589 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.8 -28.65 64.8 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.412 -0.805 . . . . 0.0 109.877 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.67 -36.91 14.09 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.458 -0.776 . . . . 0.0 110.218 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.75 -31.19 64.74 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.9 m -84.82 -35.54 22.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.414 -0.804 . . . . 0.0 110.239 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.41 -27.7 67.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.276 -0.89 . . . . 0.0 110.245 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.27 -28.38 47.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.349 -0.844 . . . . 0.0 110.164 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.78 -37.0 27.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.318 -0.864 . . . . 0.0 110.145 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -106.86 24.8 12.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.417 -0.802 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -122.09 -40.66 0.51 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.417 ' HA ' HD13 ' A' ' 54' ' ' ILE . 8.9 mm -85.03 -27.4 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.4 -1.059 . . . . 0.0 110.153 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.58 -51.89 17.84 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.273 -0.892 . . . . 0.0 110.179 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.1 t -67.18 155.6 38.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.347 -0.845 . . . . 0.0 110.168 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.7 m -85.34 100.83 12.09 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.293 -0.879 . . . . 0.0 110.155 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -142.3 45.87 0.9 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.1 m -92.18 52.09 1.9 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -1.116 . . . . 0.0 110.138 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -110.41 84.97 2.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -167.53 -48.77 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.321 -0.862 . . . . 0.0 110.299 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.456 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.2 OUTLIER -125.26 68.35 1.14 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.337 -0.852 . . . . 0.0 110.217 -179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.78 -30.79 70.25 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.384 -0.822 . . . . 0.0 110.323 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -75.9 -29.78 58.58 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.239 -0.913 . . . . 0.0 109.163 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.456 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -62.84 -36.29 82.73 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.434 -0.906 . . . . 0.0 108.69 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -29.09 64.64 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.489 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.5 tt -78.73 -37.68 40.77 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.51 -0.744 . . . . 0.0 109.803 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.436 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.04 -50.71 7.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.5 -0.75 . . . . 0.0 110.38 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.3 tpp -57.64 -42.97 84.52 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.264 -0.898 . . . . 0.0 110.438 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.8 m -68.35 -41.73 80.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.337 -0.852 . . . . 0.0 110.571 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.436 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.3 tp -82.95 -14.98 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.253 -0.904 . . . . 0.0 110.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 68' ' ' LYS . 8.2 t -74.15 -45.33 49.43 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.889 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -79.59 -26.42 41.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.44 -0.788 . . . . 0.0 109.956 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -81.65 -40.98 22.1 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.347 -0.846 . . . . 0.0 110.153 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.84 -44.92 79.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.348 -0.845 . . . . 0.0 110.111 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.58 94.04 0.08 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.403 -0.811 . . . . 0.0 110.226 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.94 78.8 0.04 OUTLIER Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' GLY . 2.2 tmm_? 53.4 57.58 6.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.344 -1.092 . . . . 0.0 110.373 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 79' ' ' THR . 6.8 t -63.37 80.1 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.39 -0.819 . . . . 0.0 109.567 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.45 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 75.92 -57.04 3.11 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.229 -1.948 . . . . 0.0 108.229 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.759 HD23 ' HD2' ' A' ' 82' ' ' PRO . 0.2 OUTLIER 174.85 147.08 0.23 Allowed Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.633 -0.922 . . . . 0.0 109.136 179.418 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.759 ' HD2' HD23 ' A' ' 81' ' ' LEU . 46.4 Cg_endo -73.31 50.72 1.97 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.505 1.266 . . . . 0.0 110.268 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -54.3 105.62 0.16 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.85 -27.99 61.37 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.378 -0.826 . . . . 0.0 110.023 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.7 t -57.77 -27.47 63.1 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.267 -0.896 . . . . 0.0 110.242 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.4 m -87.02 -27.89 22.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.354 -0.842 . . . . 0.0 110.106 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.7 mtt -63.27 114.26 3.69 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.828 . . . . 0.0 110.196 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.3 p -75.66 -159.94 0.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.41 -0.807 . . . . 0.0 110.574 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.1 mt-10 -71.92 -30.32 65.23 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.462 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mm-40 -83.85 -38.07 21.66 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -45.24 85.3 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.07 -34.2 77.52 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.557 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -67.37 -33.67 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.74 -28.9 69.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.398 -0.814 . . . . 0.0 109.8 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.78 -39.31 20.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.411 -0.806 . . . . 0.0 110.355 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.95 -29.3 32.28 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.282 -0.886 . . . . 0.0 110.724 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.6 tpt -82.27 -27.47 32.38 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.241 -0.912 . . . . 0.0 109.622 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -79.39 -28.84 41.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.478 -0.764 . . . . 0.0 109.764 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.7 ttp -81.55 -26.08 35.34 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.46 -0.775 . . . . 0.0 110.256 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -83.07 -31.8 27.15 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.261 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.44 -36.42 65.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.317 -0.864 . . . . 0.0 110.06 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -86.33 -24.25 25.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.267 -0.895 . . . . 0.0 110.329 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -134.04 97.51 0.3 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.25 67.69 6.16 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.362 -1.081 . . . . 0.0 110.291 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 51.74 44.42 29.28 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.306 -0.871 . . . . 0.0 110.544 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -98.25 31.03 2.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.453 -0.78 . . . . 0.0 110.306 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -96.9 84.06 0.78 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -91.16 50.64 1.8 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.345 -1.091 . . . . 0.0 110.228 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -114.64 -24.71 8.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.352 -0.842 . . . . 0.0 110.399 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -95.79 38.51 1.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.286 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.79 -31.3 25.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.308 -0.87 . . . . 0.0 110.17 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.196 179.886 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.479 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.0 ttp . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.213 0.53 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -88.21 138.69 31.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 109.855 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.6 pt -137.42 158.82 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.343 -0.848 . . . . 0.0 110.365 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -111.84 142.55 44.07 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.616 -0.677 . . . . 0.0 110.628 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t -127.97 119.59 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.383 -0.823 . . . . 0.0 109.507 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.453 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.7 mtpm? -100.32 131.15 46.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.313 -0.867 . . . . 0.0 110.803 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.2 p -96.21 176.86 5.92 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 110.18 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 44.7 mt -61.62 -15.08 36.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.449 -0.782 . . . . 0.0 110.954 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 78.0 p -95.8 19.88 10.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.041 -1.037 . . . . 0.0 110.767 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.91 12.83 58.26 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.06 34.86 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.088 -1.242 . . . . 0.0 109.729 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 25.1 m -112.88 126.75 55.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.273 -0.892 . . . . 0.0 110.42 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.3 mt -109.31 138.54 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.507 -0.746 . . . . 0.0 110.39 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.3 m -101.93 119.71 39.23 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.429 -0.794 . . . . 0.0 109.13 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.405 HD23 ' HE3' ' B' ' 33' ' ' LYS . 30.0 mt -123.47 160.68 26.4 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.055 -178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 114.91 29.32 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.527 -0.733 . . . . 0.0 109.409 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.479 ' O ' ' HB3' ' B' ' 1' ' ' MET . 28.4 m -140.16 176.99 4.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.296 -0.878 . . . . 0.0 110.882 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.483 ' O ' HD12 ' B' ' 56' ' ' LEU . 5.5 mt-10 -113.29 164.21 16.26 Favored Pre-proline 0 N--CA 1.49 1.536 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -72.9 -26.07 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 123.543 1.286 . . . . 0.0 110.346 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 -3.13 58.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.212 -0.93 . . . . 0.0 110.739 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.27 144.1 50.14 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.139 -0.976 . . . . 0.0 110.617 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 67.5 p -83.15 158.48 22.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.535 -0.728 . . . . 0.0 110.206 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.854 HG23 HD12 ' B' ' 43' ' ' LEU . 43.7 mm -59.58 -36.97 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 109.542 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.74 -35.46 76.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.453 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -70.44 -32.99 70.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.468 -0.77 . . . . 0.0 109.351 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.2 t -69.94 -39.8 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.0 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.412 ' HE2' HG22 ' B' ' 23' ' ' ILE . 18.6 mtmt -62.99 -41.19 99.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 109.036 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.42 77.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.573 -0.704 . . . . 0.0 109.391 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -37.5 81.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.437 -0.789 . . . . 0.0 109.388 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.4 mt -67.18 -37.46 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.769 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -60.71 -51.28 70.03 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.549 -0.719 . . . . 0.0 109.531 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -58.13 -27.25 63.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.55 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.405 ' HE3' HD23 ' B' ' 15' ' ' LEU . 21.3 mmtt -84.07 -39.47 19.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.214 -0.929 . . . . 0.0 110.841 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -108.16 -55.75 2.33 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.249 -0.907 . . . . 0.0 110.6 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.2 14.24 2.03 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.496 HG23 ' HD2' ' B' ' 37' ' ' PRO . 13.8 mt -91.17 143.81 28.95 Favored Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.115 -1.227 . . . . 0.0 109.573 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.496 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.7 Cg_endo -68.38 131.74 23.99 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 O-C-N 123.631 1.332 . . . . 0.0 110.6 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.01 -25.41 81.44 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.719 1.378 . . . . 0.0 110.777 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -68.69 -24.13 64.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 109.768 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -101.19 2.59 40.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.455 -0.778 . . . . 0.0 110.427 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -94.35 141.95 27.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.234 -0.916 . . . . 0.0 110.473 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.36 131.77 45.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.529 -0.732 . . . . 0.0 109.801 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.854 HD12 HG23 ' B' ' 23' ' ' ILE . 18.2 mt -104.62 120.86 42.29 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.349 -0.844 . . . . 0.0 110.467 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.801 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.08 133.01 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.496 -0.753 . . . . 0.0 109.65 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.532 ' HB2' HD23 ' B' ' 67' ' ' LEU . 40.1 t80 -140.65 150.66 43.82 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.416 -0.803 . . . . 0.0 110.16 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.68 0.46 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.457 -0.777 . . . . 0.0 111.217 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.466 ' HA2' HD23 ' A' ' 26' ' ' LEU . . . 77.51 2.48 80.27 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 6.5 mttt -110.97 137.46 48.57 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.968 -1.313 . . . . 0.0 110.239 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.49 134.35 37.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.397 -0.814 . . . . 0.0 109.688 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.809 HD12 ' HB3' ' B' ' 43' ' ' LEU . 31.9 mt -83.8 141.04 31.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.232 -0.917 . . . . 0.0 110.306 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -93.49 129.32 39.73 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.358 -0.839 . . . . 0.0 110.524 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 73.1 m-20 -48.29 -26.11 1.86 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.525 -0.734 . . . . 0.0 111.229 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.78 -9.31 84.72 Favored Glycine 0 N--CA 1.493 2.482 0 C-N-CA 120.139 -1.029 . . . . 0.0 110.553 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -99.35 156.8 16.82 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.994 -1.297 . . . . 0.0 110.483 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 31.8 p -102.38 167.65 9.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.367 -0.833 . . . . 0.0 110.181 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.604 ' HA ' HD12 ' B' ' 61' ' ' ILE . 86.6 mt -53.69 -47.02 70.86 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.255 -0.903 . . . . 0.0 110.629 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.76 -34.71 67.85 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.368 -0.833 . . . . 0.0 111.083 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.63 -29.46 68.03 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.152 -0.967 . . . . 0.0 110.384 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.636 ' CG ' HD22 ' B' ' 50' ' ' LEU . 47.3 m-85 -101.24 28.97 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.835 . . . . 0.0 109.867 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.69 28.43 3.55 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.593 -0.692 . . . . 0.0 110.785 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.604 HD12 ' HA ' ' B' ' 56' ' ' LEU . 97.4 mt -81.36 108.54 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 109.741 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -105.73 173.53 6.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.379 -0.826 . . . . 0.0 110.366 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.4 OUTLIER -46.55 152.36 0.47 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.526 -0.734 . . . . 0.0 110.933 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.6 mm-40 62.97 15.87 8.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.701 -0.624 . . . . 0.0 110.59 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.65 144.93 49.22 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.176 -0.952 . . . . 0.0 110.079 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.9 m -107.56 106.83 17.38 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.33 -0.856 . . . . 0.0 109.929 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.532 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.4 mt -102.57 160.49 14.52 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.448 ' NE2' HG12 ' A' ' 28' ' ' VAL . 60.6 m80 -108.88 135.91 49.31 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -0.885 . . . . 0.0 109.936 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.2 tp -107.13 131.65 53.89 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.291 -0.881 . . . . 0.0 110.411 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.435 ' CG1' ' HB3' ' A' ' 21' ' ' GLU . 19.4 t -125.09 149.27 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.395 -0.816 . . . . 0.0 110.121 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 26.7 mt -94.69 91.47 6.54 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.411 -0.806 . . . . 0.0 110.278 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 71.17 3.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.353 -0.842 . . . . 0.0 110.24 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.14 160.63 2.8 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.298 -0.876 . . . . 0.0 110.391 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 53.36 89.2 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.326 -0.859 . . . . 0.0 110.409 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -132.6 -111.41 1.3 Allowed Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.989 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.194 0.521 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -167.53 -168.54 1.05 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.84 23.22 14.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.457 -0.777 . . . . 0.0 109.526 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.63 -24.77 49.0 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER 54.3 57.64 5.68 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.384 -1.068 . . . . 0.0 110.34 -179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.1 84.94 0.14 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.709 -1.357 . . . . 0.0 109.709 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.3 72.12 0.42 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.321 -1.105 . . . . 0.0 110.534 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.8 t -165.55 -53.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.408 -0.807 . . . . 0.0 109.938 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -68.06 -26.88 66.08 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.409 -0.807 . . . . 0.0 110.12 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.561 ' HA ' HG11 ' A' ' 14' ' ' VAL . 22.8 m-85 -101.67 42.66 1.11 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.359 -0.838 . . . . 0.0 110.228 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -146.14 34.15 0.99 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.409 -0.807 . . . . 0.0 109.981 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -163.43 40.53 0.1 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.403 -0.811 . . . . 0.0 110.054 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 162.3 -29.88 0.28 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.561 HG11 ' HA ' ' A' ' 10' ' ' PHE . 9.8 p -96.86 -23.47 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.419 -1.048 . . . . 0.0 110.223 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.74 171.77 0.15 Allowed Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.489 -0.757 . . . . 0.0 110.444 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.95 -22.71 26.27 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 O-C-N 123.86 1.452 . . . . 0.0 110.616 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.7 m -66.68 -14.53 62.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.279 -0.888 . . . . 0.0 110.455 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.73 -34.25 30.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.282 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -169.49 118.67 0.57 Allowed Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.36 -0.837 . . . . 0.0 110.063 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.39 -14.69 34.34 Favored 'Trans proline' 0 C--N 1.306 -1.658 0 O-C-N 123.984 1.518 . . . . 0.0 109.989 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.536 ' HB3' HG11 ' B' ' 70' ' ' VAL . 7.5 mt-10 -73.95 -31.14 62.9 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 109.261 179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.3 mt -84.92 -31.11 23.83 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.82 77.86 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.5 -0.75 . . . . 0.0 109.438 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.641 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -79.75 -35.96 38.0 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.453 -0.78 . . . . 0.0 109.664 179.47 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.503 ' CB ' HD12 ' B' ' 44' ' ' ILE . . . -77.67 -31.89 52.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.422 -0.798 . . . . 0.0 110.038 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -78.03 -21.52 50.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.436 -0.79 . . . . 0.0 110.178 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.37 -35.52 30.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.247 -0.908 . . . . 0.0 108.96 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 24' ' ' LEU . 89.6 t -71.41 -31.15 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.62 -0.675 . . . . 0.0 109.53 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 m -72.94 -41.29 64.63 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.469 -0.77 . . . . 0.0 109.915 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 mtt -62.77 -31.06 71.94 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.426 -0.796 . . . . 0.0 109.928 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -31.6 62.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 110.016 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -43.92 46.24 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.413 -0.804 . . . . 0.0 110.014 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -45.39 90.97 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.054 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.59 -35.69 80.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.381 -0.825 . . . . 0.0 110.056 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -54.89 41.72 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.37 -0.831 . . . . 0.0 110.268 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.8 mtt-85 -62.63 -48.5 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.5 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 8.8 mt-30 -63.0 -27.16 69.23 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.336 -0.853 . . . . 0.0 110.191 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -76.67 -53.41 8.04 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.487 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -55.15 -33.78 63.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 108.977 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.39 -35.54 23.06 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.722 -0.612 . . . . 0.0 109.571 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -71.15 -55.91 7.18 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.762 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -56.5 -43.53 79.79 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.512 -0.743 . . . . 0.0 110.229 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.6 ttm180 -54.78 -43.03 72.46 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.3 -0.875 . . . . 0.0 109.906 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.07 -27.59 57.28 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.448 -0.783 . . . . 0.0 109.785 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.97 -27.12 54.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.431 -0.793 . . . . 0.0 110.081 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.67 -45.3 19.28 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 110.032 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.56 -29.13 66.63 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.158 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -83.35 -34.8 25.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.366 -0.834 . . . . 0.0 110.193 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.56 -38.75 74.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.074 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.22 -15.31 60.06 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.357 -0.84 . . . . 0.0 110.327 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -103.87 -42.42 5.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.243 -0.911 . . . . 0.0 110.374 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -125.31 29.7 5.99 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.301 -0.874 . . . . 0.0 110.381 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -110.88 -61.72 0.49 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.568 ' N ' HD12 ' A' ' 54' ' ' ILE . 5.1 mp -100.61 -15.94 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -1.103 . . . . 0.0 110.447 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.438 ' O ' HG23 ' A' ' 56' ' ' THR . . . -66.12 80.86 0.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.274 -0.891 . . . . 0.0 110.172 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 55' ' ' ALA . 0.8 OUTLIER -153.62 67.14 0.76 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 57' ' ' THR . 6.4 t -144.53 96.75 2.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.16 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -168.74 -120.44 0.53 Allowed Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.8 t -167.48 46.31 0.05 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.461 -1.023 . . . . 0.0 110.266 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -101.25 48.68 0.89 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.333 -0.854 . . . . 0.0 110.127 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.58 -46.6 30.92 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.407 -0.808 . . . . 0.0 110.254 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.76 70.52 0.9 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.23 -0.919 . . . . 0.0 110.17 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -77.36 -51.26 11.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.38 -32.48 58.59 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.205 -0.934 . . . . 0.0 109.21 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.69 80.86 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 108.901 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mp -70.16 -30.68 67.88 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.648 ' O ' HD13 ' A' ' 67' ' ' LEU . 3.1 tm? -73.87 -42.95 60.01 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.453 -0.779 . . . . 0.0 109.46 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -80.41 -53.25 6.77 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.424 -0.797 . . . . 0.0 110.599 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -53.77 -38.51 64.51 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.109 -0.995 . . . . 0.0 110.623 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 47.3 m -70.31 -41.36 73.4 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.264 -0.898 . . . . 0.0 110.494 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.446 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.8 tp -84.34 -14.55 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.173 -0.954 . . . . 0.0 110.368 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -75.66 -44.67 41.31 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.284 -0.885 . . . . 0.0 109.658 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -79.06 -27.04 43.04 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.483 -0.761 . . . . 0.0 109.967 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -81.97 -49.04 10.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.359 -0.838 . . . . 0.0 110.229 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -60.75 -37.87 83.3 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.223 -0.923 . . . . 0.0 110.101 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -98.44 102.25 13.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.354 -0.841 . . . . 0.0 110.015 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -142.31 88.97 0.18 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.3 100.77 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.36 -1.083 . . . . 0.0 110.419 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.3 m -127.44 44.43 2.92 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.172 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.02 24.39 32.49 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.739 -1.345 . . . . 0.0 109.739 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.74 149.78 1.31 Allowed Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.274 -1.133 . . . . 0.0 108.967 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -72.17 63.18 3.43 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 123.556 1.292 . . . . 0.0 110.363 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -70.0 134.73 48.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.433 -0.792 . . . . 0.0 110.358 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.2 mt -117.42 -39.41 3.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.395 -0.816 . . . . 0.0 110.045 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.6 m -75.5 -2.66 29.94 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.416 -0.802 . . . . 0.0 110.683 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -109.27 12.2 24.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.005 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.425 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 3.9 mtt -111.36 -159.4 0.68 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -0.877 . . . . 0.0 109.952 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p -137.79 -171.78 3.08 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.27 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.58 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.5 pt-20 -66.07 -33.55 76.04 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.445 -0.784 . . . . 0.0 109.456 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.431 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 29.2 mt-10 -85.2 -39.73 17.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.662 -0.649 . . . . 0.0 109.543 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.12 -41.67 90.21 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 178.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 87' ' ' MET . 74.0 mt-30 -69.98 -34.63 73.61 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.58 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -58.76 -34.97 53.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.1 -48.71 61.88 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.57 -0.706 . . . . 0.0 109.519 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -65.71 -34.12 77.46 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.519 -0.738 . . . . 0.0 109.943 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.77 -37.2 41.64 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.411 -0.805 . . . . 0.0 110.071 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 52.7 tpp -81.15 -25.95 36.46 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.286 -0.884 . . . . 0.0 109.79 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -71.97 -56.41 5.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.414 -0.804 . . . . 0.0 109.82 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 27.3 mtm -62.99 -27.21 69.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.491 -0.756 . . . . 0.0 109.97 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.3 t -74.22 -28.63 61.34 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.031 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.3 mp -109.81 21.57 16.73 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.427 -0.796 . . . . 0.0 110.192 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -107.05 -38.92 5.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.282 -0.886 . . . . 0.0 110.27 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -163.06 102.15 0.2 Allowed Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -159.83 108.02 1.73 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.381 -1.07 . . . . 0.0 110.33 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.16 -14.45 14.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.308 -0.87 . . . . 0.0 110.453 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -25.48 66.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.187 -0.945 . . . . 0.0 110.081 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.95 97.6 0.16 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.75 77.89 1.79 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.317 -1.108 . . . . 0.0 110.157 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -135.17 61.38 1.67 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.371 -0.83 . . . . 0.0 110.237 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -136.23 38.51 2.73 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.355 -0.841 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.8 p -140.4 -65.75 0.45 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.288 -0.882 . . . . 0.0 110.266 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.191 -179.989 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.458 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 39.3 ttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.339 0.59 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -120.44 139.17 53.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.486 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.529 HD13 HG21 ' B' ' 17' ' ' VAL . 45.0 pt -137.55 158.33 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.223 -0.923 . . . . 0.0 110.514 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -111.78 145.56 39.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.608 -0.683 . . . . 0.0 110.297 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' B' ' 12' ' ' THR . 60.7 t -128.18 122.63 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.373 -0.829 . . . . 0.0 109.844 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.434 ' HG3' HG23 ' B' ' 12' ' ' THR . 0.1 OUTLIER -100.13 135.9 40.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.358 -0.839 . . . . 0.0 110.182 -179.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.2 p -95.67 171.52 8.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.39 -0.819 . . . . 0.0 110.583 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.477 HD21 HG22 ' B' ' 70' ' ' VAL . 4.5 mm? -61.26 -13.28 17.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.506 -0.746 . . . . 0.0 111.192 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 75.8 p -95.44 -21.06 18.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.119 -0.988 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.89 9.2 14.16 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.941 -1.123 . . . . 0.0 110.394 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 131.76 34.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.071 -1.252 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.434 HG23 ' HG3' ' B' ' 6' ' ' LYS . 1.8 m -113.02 122.24 47.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.121 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mt -109.11 137.0 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.401 -0.812 . . . . 0.0 110.335 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 31.1 m -102.11 122.14 43.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.516 HD11 HG12 ' B' ' 30' ' ' ILE . 82.5 mt -123.44 161.45 24.78 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.171 -0.955 . . . . 0.0 110.806 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -106.25 116.12 31.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.534 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.529 HG21 HD13 ' B' ' 3' ' ' ILE . 34.9 m -140.03 179.12 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.336 -0.853 . . . . 0.0 110.627 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.569 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.4 mp0 -113.12 165.18 13.75 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.495 -0.753 . . . . 0.0 109.29 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.51 -27.59 15.49 Favored 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.593 1.312 . . . . 0.0 110.338 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.44 -2.34 57.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.214 -0.928 . . . . 0.0 110.494 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -71.21 143.27 50.51 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.23 -0.919 . . . . 0.0 110.44 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 82.5 p -83.22 160.33 21.8 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.513 -0.742 . . . . 0.0 110.261 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.435 HG13 ' HB3' ' B' ' 50' ' ' LEU . 48.4 mm -59.83 -38.16 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.313 -0.867 . . . . 0.0 109.47 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.41 -33.43 72.49 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.388 -0.82 . . . . 0.0 109.365 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -70.32 -35.27 73.54 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.537 -0.727 . . . . 0.0 109.217 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.65 -37.17 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.458 -0.776 . . . . 0.0 108.926 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -63.08 -42.16 99.57 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.445 -0.784 . . . . 0.0 108.922 178.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.19 75.1 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.606 -0.684 . . . . 0.0 109.325 179.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.496 ' HE3' HG12 ' B' ' 17' ' ' VAL . 14.4 mttt -68.35 -38.55 81.56 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.464 -0.773 . . . . 0.0 109.633 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.516 HG12 HD11 ' B' ' 15' ' ' LEU . 10.9 mt -67.26 -40.93 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 109.223 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -48.68 80.71 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.421 -0.8 . . . . 0.0 109.497 179.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -57.89 -28.03 63.84 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.505 -0.747 . . . . 0.0 110.206 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 15.7 mmtt -83.53 -42.66 16.58 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 110.146 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -108.33 -118.18 0.27 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.444 -0.785 . . . . 0.0 109.743 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.8 23.93 0.22 Allowed Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.783 -1.199 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.458 HG23 ' HD2' ' B' ' 37' ' ' PRO . 81.7 mt -91.88 142.2 26.26 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.205 -1.173 . . . . 0.0 110.21 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -69.48 134.15 27.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 O-C-N 123.698 1.367 . . . . 0.0 110.269 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.74 -26.32 82.77 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.717 1.377 . . . . 0.0 110.84 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -68.79 -24.98 64.48 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.305 -0.872 . . . . 0.0 109.941 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 30.9 mt-30 -101.27 7.38 42.94 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.396 -0.815 . . . . 0.0 110.514 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -94.38 138.05 32.8 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.483 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.415 ' C ' HD22 ' B' ' 43' ' ' LEU . 2.7 ttm180 -130.32 127.81 40.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.449 -0.782 . . . . 0.0 109.627 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.547 ' HB3' HD12 ' B' ' 50' ' ' LEU . 4.4 mm? -104.49 125.01 50.28 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.35 -0.844 . . . . 0.0 110.609 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.503 HD12 ' CB ' ' A' ' 25' ' ' ALA . 1.6 mt -122.25 141.11 43.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.566 -0.709 . . . . 0.0 110.31 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.664 ' HB3' HD21 ' B' ' 50' ' ' LEU . 47.1 t80 -141.65 148.2 38.76 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.522 -0.736 . . . . 0.0 109.863 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.25 0.3 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.511 -0.743 . . . . 0.0 111.482 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.21 1.99 90.27 Favored Glycine 0 N--CA 1.495 2.617 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.743 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -110.8 141.89 43.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.924 -1.339 . . . . 0.0 110.296 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -78.35 132.54 37.45 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 109.784 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.664 HD21 ' HB3' ' B' ' 45' ' ' PHE . 17.9 mt -84.05 142.79 30.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.232 -0.917 . . . . 0.0 110.08 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -93.45 132.75 37.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.358 -0.839 . . . . 0.0 110.406 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.41 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 0.9 OUTLIER -48.42 -30.45 5.08 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.55 -0.719 . . . . 0.0 111.019 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.81 -2.66 90.67 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -99.54 153.73 18.81 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.101 -1.235 . . . . 0.0 110.343 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.8 p -102.19 164.18 11.83 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.85 . . . . 0.0 110.103 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.628 ' HA ' HD12 ' B' ' 61' ' ' ILE . 83.7 mt -53.58 -47.3 70.25 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.297 -0.877 . . . . 0.0 110.683 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 17.8 p -56.8 -36.04 69.45 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.396 -0.815 . . . . 0.0 111.214 -179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.44 -28.91 67.4 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.124 -0.985 . . . . 0.0 110.403 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.651 ' CD2' HD22 ' B' ' 50' ' ' LEU . 35.9 m-85 -101.19 28.32 5.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.419 -0.8 . . . . 0.0 109.908 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 50.77 28.45 3.63 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.596 -0.69 . . . . 0.0 110.669 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' B' ' 56' ' ' LEU . 92.4 mt -81.4 108.88 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.253 -0.904 . . . . 0.0 109.764 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -105.45 173.28 6.37 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.388 -0.82 . . . . 0.0 110.348 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.3 ptmt -46.76 152.77 0.45 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.504 -0.748 . . . . 0.0 111.085 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 63.17 14.98 8.17 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.805 -0.559 . . . . 0.0 111.012 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.3 m -71.5 145.25 49.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.124 -0.985 . . . . 0.0 110.012 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . 0.402 ' C ' HD22 ' B' ' 67' ' ' LEU . 86.5 m -107.6 109.8 21.53 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.416 -0.803 . . . . 0.0 109.987 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.693 HD22 ' N ' ' B' ' 67' ' ' LEU . 2.9 mm? -102.47 160.53 14.47 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.309 -0.87 . . . . 0.0 110.134 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' B' ' 44' ' ' ILE . 9.1 m-70 -108.64 134.62 51.13 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.3 -0.875 . . . . 0.0 109.688 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.41 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 35.8 tp -107.15 127.57 53.62 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 110.129 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.536 HG11 ' HB3' ' A' ' 21' ' ' GLU . 44.2 t -124.87 165.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.435 -0.791 . . . . 0.0 110.02 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.42 ' N ' HG12 ' B' ' 70' ' ' VAL . 74.5 mt -93.94 109.44 21.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -84.67 117.32 23.71 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' B' ' 73' ' ' LEU . 7.8 mt -79.13 126.38 30.65 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.363 -0.836 . . . . 0.0 110.25 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -102.8 107.88 18.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.349 -0.845 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.94 -45.94 0.04 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 CA-C-O 117.979 -1.456 . . . . 0.0 109.552 -179.928 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.845 0 CA-C-O 121.201 0.524 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.592 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 3.2 tmm? -74.76 -17.74 60.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.592 ' CB ' ' O ' ' A' ' 2' ' ' MET . 0.2 OUTLIER 82.45 38.14 0.05 Allowed 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 -179.031 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.51 -51.75 2.29 Favored Glycine 0 N--CA 1.482 1.755 0 N-CA-C 109.697 -1.361 . . . . 0.0 109.697 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.33 70.94 2.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.42 -1.047 . . . . 0.0 110.308 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -133.72 -64.82 0.07 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.45 22.42 1.32 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.371 -1.076 . . . . 0.0 110.354 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.42 -31.54 3.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 110.439 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.05 -41.75 88.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.287 -0.883 . . . . 0.0 110.314 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.498 ' CE2' HG21 ' A' ' 14' ' ' VAL . 2.2 m-85 -93.3 87.09 5.51 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.449 -0.782 . . . . 0.0 110.182 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -114.28 63.54 0.66 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.44 -0.788 . . . . 0.0 109.919 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 58.48 25.67 13.3 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.341 -0.849 . . . . 0.0 110.176 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -100.94 -12.93 35.51 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.804 -1.319 . . . . 0.0 109.804 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.498 HG21 ' CE2' ' A' ' 10' ' ' PHE . 91.6 t -61.98 -67.36 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.283 -1.128 . . . . 0.0 110.129 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -137.42 163.08 51.31 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.344 -0.847 . . . . 0.0 110.436 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.73 -19.39 27.68 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 O-C-N 123.828 1.436 . . . . 0.0 110.67 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.5 t -67.93 -12.43 60.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.36 -20.22 60.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.197 -0.94 . . . . 0.0 110.551 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.588 ' CB ' HD12 ' A' ' 22' ' ' LEU . 0.2 OUTLIER -169.51 121.2 0.62 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.175 -0.953 . . . . 0.0 109.829 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -69.7 -15.36 37.28 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 123.957 1.504 . . . . 0.0 110.234 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.487 ' OE2' HD12 ' B' ' 73' ' ' LEU . 0.3 OUTLIER -76.44 -31.64 57.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.839 . . . . 0.0 109.302 179.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.588 HD12 ' CB ' ' A' ' 19' ' ' ASP . 17.6 mt -85.32 -29.38 24.57 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.458 -0.776 . . . . 0.0 109.081 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.29 -32.62 68.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.545 -0.722 . . . . 0.0 109.295 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.68 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -82.39 -37.32 25.73 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.575 -0.703 . . . . 0.0 109.524 179.299 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.48 ' HB2' HG21 ' B' ' 70' ' ' VAL . . . -68.58 -35.5 77.46 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.375 -0.828 . . . . 0.0 109.87 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.727 ' O ' HD13 ' A' ' 26' ' ' LEU . 0.4 OUTLIER -80.58 -23.54 39.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.454 -0.778 . . . . 0.0 110.137 179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.53 -33.54 25.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.209 -0.932 . . . . 0.0 109.588 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 24' ' ' LEU . 88.6 t -75.86 -41.8 39.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.519 -0.738 . . . . 0.0 109.642 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 m -70.91 -40.11 72.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.61 -42.8 93.44 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.37 -0.831 . . . . 0.0 109.976 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -64.25 -32.1 73.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 109.913 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -64.42 -51.14 64.67 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.388 -0.82 . . . . 0.0 109.92 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -60.56 -36.38 78.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.388 -0.82 . . . . 0.0 109.979 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.0 -36.73 84.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.399 -0.813 . . . . 0.0 109.744 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -62.69 -43.73 98.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.422 -0.799 . . . . 0.0 109.831 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 -70.11 -37.14 75.28 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.377 -0.827 . . . . 0.0 109.81 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -70.84 -26.56 63.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.5 -0.75 . . . . 0.0 109.933 179.768 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.39 -57.23 3.94 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.518 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -52.56 -31.65 37.07 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.371 -0.83 . . . . 0.0 109.023 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -85.33 -37.49 19.88 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.543 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -65.93 -55.79 15.08 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.752 179.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -61.93 -31.65 71.99 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.426 -0.797 . . . . 0.0 109.986 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -40.51 81.2 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.33 -0.856 . . . . 0.0 109.899 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -36.16 68.41 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.453 -0.779 . . . . 0.0 109.812 179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.9 -31.15 71.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.465 -0.772 . . . . 0.0 109.919 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.69 -36.18 65.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.428 -0.795 . . . . 0.0 110.081 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -75.75 -32.78 60.13 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.374 -0.829 . . . . 0.0 110.211 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.17 -43.66 61.11 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.395 -0.815 . . . . 0.0 110.139 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.98 74.57 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.455 -0.778 . . . . 0.0 110.148 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.2 -25.81 55.5 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -60.78 -37.96 83.66 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.299 -0.875 . . . . 0.0 110.098 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -97.97 -28.4 13.81 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.838 . . . . 0.0 110.133 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.06 20.7 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.4 mm -107.77 90.42 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.391 -1.064 . . . . 0.0 109.999 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -151.63 76.47 1.2 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.322 -0.862 . . . . 0.0 110.256 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -149.89 152.16 34.62 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.342 -0.849 . . . . 0.0 110.195 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.1 m -117.61 102.55 9.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 110.164 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.423 ' O ' HG23 ' A' ' 59' ' ' THR . . . -140.05 -91.35 0.2 Allowed Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 58' ' ' GLY . 0.4 OUTLIER -155.26 75.26 0.94 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.374 -1.074 . . . . 0.0 110.214 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -133.29 85.45 2.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.283 -0.885 . . . . 0.0 110.244 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.25 -42.84 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.382 -0.824 . . . . 0.0 110.228 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.42 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.3 OUTLIER -125.08 76.13 1.51 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.339 -0.851 . . . . 0.0 110.074 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -76.66 -40.0 50.4 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.356 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -78.52 -32.28 47.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.212 -0.93 . . . . 0.0 109.131 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -60.79 -44.67 96.51 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.823 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.43 -29.56 70.61 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.45 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.2 tt -75.49 -37.92 59.85 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.518 -0.739 . . . . 0.0 109.785 179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -82.81 -55.43 4.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 110.476 -179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 ttt -52.87 -41.61 64.47 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.17 -0.956 . . . . 0.0 110.687 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 83.7 m -69.01 -40.85 78.43 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.315 -0.866 . . . . 0.0 110.508 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 68' ' ' LYS . 4.1 tp -80.07 -18.16 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.166 -0.959 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.93 -38.24 69.89 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.324 -0.86 . . . . 0.0 109.535 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -79.21 -31.78 43.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.461 -0.775 . . . . 0.0 109.673 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -80.13 -51.54 8.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.451 -0.781 . . . . 0.0 109.865 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.28 -23.69 66.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.371 -0.831 . . . . 0.0 110.122 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.4 107.22 0.17 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.332 -0.855 . . . . 0.0 110.497 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 167.26 -49.85 0.24 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.391 -1.483 . . . . 0.0 109.391 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -105.33 113.52 27.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.466 -1.02 . . . . 0.0 109.989 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -140.28 34.3 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.29 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.502 ' C ' HD12 ' A' ' 81' ' ' LEU . . . -100.69 34.84 5.27 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 80' ' ' GLY . 0.4 OUTLIER -160.22 145.16 11.02 Favored Pre-proline 0 N--CA 1.485 1.318 0 O-C-N 121.428 -1.042 . . . . 0.0 108.723 179.782 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -76.0 38.49 0.59 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.455 1.239 . . . . 0.0 110.762 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 50.4 91.81 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.179 -0.95 . . . . 0.0 110.701 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.619 ' O ' HD13 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -96.51 -24.79 15.91 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.357 -0.839 . . . . 0.0 110.202 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -60.41 -27.72 67.68 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.313 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.4 t -91.2 -24.85 19.79 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.311 -0.868 . . . . 0.0 110.324 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.408 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 32.0 mtt -67.41 117.53 9.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.402 -0.811 . . . . 0.0 110.324 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.2 p -79.37 -163.33 0.49 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.408 -0.807 . . . . 0.0 110.377 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.53 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 9.6 pt-20 -67.71 -32.23 72.72 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.468 -0.77 . . . . 0.0 109.258 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.426 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 32.7 mt-10 -85.35 -39.74 17.3 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.81 -44.78 92.25 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.469 ' CD ' HD11 ' A' ' 84' ' ' LEU . 59.3 mt-30 -66.13 -35.7 81.19 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.37 -33.79 65.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 178.856 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.76 -48.64 78.29 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 109.875 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -38.52 65.62 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.42 -0.8 . . . . 0.0 109.698 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.2 -37.89 86.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.446 -0.784 . . . . 0.0 109.992 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 11.5 ttm -80.66 -26.96 37.29 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.357 -0.839 . . . . 0.0 109.704 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -33.57 75.91 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.498 -0.751 . . . . 0.0 109.877 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 25.7 mtt -86.27 -28.92 23.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.451 -0.781 . . . . 0.0 110.097 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.74 -28.89 55.95 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.405 -0.809 . . . . 0.0 110.148 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.8 tp -85.16 5.33 30.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -65.38 -29.33 70.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.23 -0.919 . . . . 0.0 110.244 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 93.1 121.51 3.1 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -92.63 78.99 4.85 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.409 -1.054 . . . . 0.0 110.227 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -65.42 -44.26 87.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -91.08 -67.53 0.85 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.312 -0.868 . . . . 0.0 110.185 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.11 -58.09 5.02 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -82.36 67.07 8.24 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.322 -1.105 . . . . 0.0 110.184 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.32 42.84 2.31 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.378 -0.826 . . . . 0.0 110.171 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -73.87 -34.96 64.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.406 -0.809 . . . . 0.0 110.152 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 t -105.69 41.66 1.35 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.216 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.21 -179.993 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.6 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.164 0.507 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -90.51 139.45 30.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.439 -0.788 . . . . 0.0 109.843 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -137.25 158.43 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.264 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.77 145.11 39.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.666 -0.646 . . . . 0.0 110.671 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 97.7 t -128.03 119.44 51.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 109.53 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 2.0 mtmp? -100.26 129.85 46.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.361 -0.837 . . . . 0.0 110.686 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 43.2 p -96.4 174.81 6.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.437 -0.79 . . . . 0.0 110.067 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mt -61.62 -13.56 23.21 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.312 -0.868 . . . . 0.0 110.841 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 79.0 p -95.57 19.02 11.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.106 -0.997 . . . . 0.0 110.565 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.88 11.57 58.24 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.2 OUTLIER -84.84 128.28 34.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.068 -1.254 . . . . 0.0 109.952 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.4 m -113.09 124.43 52.57 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.883 . . . . 0.0 110.117 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mt -109.14 136.88 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.48 -0.762 . . . . 0.0 110.288 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 12.0 m -102.29 120.78 41.06 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.529 -0.732 . . . . 0.0 109.502 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 69.8 mt -123.38 162.93 21.8 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 110.963 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.3 115.71 30.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.537 -0.727 . . . . 0.0 109.347 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.9 m -140.25 174.85 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.285 -0.885 . . . . 0.0 110.863 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.453 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.5 mm-40 -113.14 165.5 13.08 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.41 -24.98 22.01 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 123.507 1.267 . . . . 0.0 110.385 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.0 p -84.6 -4.62 59.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 110.474 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -71.26 139.11 49.9 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.175 -0.953 . . . . 0.0 110.683 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 57.6 p -83.67 160.21 21.38 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.51 -0.744 . . . . 0.0 110.495 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.892 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.48 -34.88 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.346 -0.846 . . . . 0.0 109.705 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.31 -37.26 80.02 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.371 -0.83 . . . . 0.0 109.386 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.54 -31.48 68.55 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.463 -0.773 . . . . 0.0 109.203 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.408 HG23 ' O ' ' B' ' 22' ' ' THR . 58.1 t -69.92 -41.64 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.515 -0.741 . . . . 0.0 109.078 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.62 ' HD2' HG22 ' B' ' 23' ' ' ILE . 4.4 mttp -62.88 -38.95 92.94 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.437 -0.789 . . . . 0.0 108.947 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.79 -36.18 80.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.488 -0.757 . . . . 0.0 109.346 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.42 ' HD3' HG12 ' B' ' 17' ' ' VAL . 7.0 mttm -68.28 -39.7 82.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.495 -0.753 . . . . 0.0 109.738 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.603 HD13 HD22 ' B' ' 69' ' ' LEU . 12.5 mt -66.92 -38.87 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.211 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.67 -50.63 72.75 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.476 -0.765 . . . . 0.0 109.578 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -57.87 -26.42 62.09 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.401 -0.812 . . . . 0.0 110.236 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mmtm -84.27 -40.46 17.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.807 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.99 -55.54 2.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.441 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.19 17.76 1.96 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.522 HG23 ' HD2' ' B' ' 37' ' ' PRO . 81.1 mt -91.45 144.52 29.78 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.157 -1.202 . . . . 0.0 109.791 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.522 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.9 Cg_endo -70.13 133.48 24.99 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.552 1.291 . . . . 0.0 110.417 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.97 -27.48 84.85 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.736 1.387 . . . . 0.0 111.046 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.83 -22.39 64.24 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.396 -0.815 . . . . 0.0 110.336 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 41.9 mm-40 -101.29 -2.29 31.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.313 -0.867 . . . . 0.0 110.646 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -94.35 143.42 26.41 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.215 -0.928 . . . . 0.0 110.397 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.517 ' NH1' HD21 ' A' ' 22' ' ' LEU . 2.9 mtt180 -130.09 132.19 46.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.942 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.892 HD12 HG23 ' B' ' 23' ' ' ILE . 20.1 mt -104.74 119.54 39.25 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.355 -0.84 . . . . 0.0 110.369 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.792 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.17 134.71 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.503 -0.748 . . . . 0.0 109.907 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.51 ' HB2' HD23 ' B' ' 67' ' ' LEU . 37.2 t80 -141.49 154.53 45.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.548 -0.72 . . . . 0.0 110.007 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.431 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.1 25.56 0.18 Allowed 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.539 -0.725 . . . . 0.0 111.513 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.34 -4.93 75.14 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.777 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.77 142.84 42.21 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.04 -1.271 . . . . 0.0 110.47 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.71 138.4 38.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.351 -0.843 . . . . 0.0 109.779 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.744 HD12 ' HB3' ' B' ' 43' ' ' LEU . 40.7 mt -84.3 148.4 26.69 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.304 -0.872 . . . . 0.0 109.998 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -93.51 125.95 38.4 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.327 -0.858 . . . . 0.0 110.394 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -48.54 -32.49 8.08 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.362 -0.836 . . . . 0.0 110.984 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.69 -1.85 90.58 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 -179.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 31.9 mmt-85 -99.57 157.88 16.14 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.066 -1.255 . . . . 0.0 110.29 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.5 p -102.55 162.22 13.09 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 110.052 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.591 ' HA ' HD12 ' B' ' 61' ' ' ILE . 93.7 mt -53.37 -45.38 69.17 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.279 -0.888 . . . . 0.0 110.649 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.87 -36.7 70.38 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.085 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.63 -27.69 66.56 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.187 -0.946 . . . . 0.0 110.361 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.48 ' CD2' HD22 ' B' ' 50' ' ' LEU . 36.9 m-85 -101.09 27.59 5.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.348 -0.845 . . . . 0.0 109.931 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 50.88 28.03 3.49 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.464 -0.773 . . . . 0.0 110.716 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.591 HD12 ' HA ' ' B' ' 56' ' ' LEU . 85.9 mt -81.43 112.04 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.349 -0.845 . . . . 0.0 109.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.63 173.02 6.49 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.38 -0.825 . . . . 0.0 110.448 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.8 pttm -46.65 154.16 0.33 Allowed 'General case' 0 N--CA 1.497 1.903 0 CA-C-O 121.492 0.663 . . . . 0.0 111.177 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.4 mt-10 62.58 15.61 8.09 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.749 -0.594 . . . . 0.0 110.805 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 141.57 49.9 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.179 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.8 m -107.61 110.63 22.56 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.292 -0.88 . . . . 0.0 109.945 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.51 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.2 mt -102.76 161.47 13.71 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.313 -0.867 . . . . 0.0 110.008 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -108.8 131.64 54.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.306 -0.871 . . . . 0.0 109.951 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.603 HD22 HD13 ' B' ' 30' ' ' ILE . 61.9 tp -106.98 133.85 51.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.217 -0.927 . . . . 0.0 110.551 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.48 HG21 ' HB2' ' A' ' 25' ' ' ALA . 45.1 t -124.96 154.39 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.35 -0.844 . . . . 0.0 110.205 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 43.4 mt -94.4 89.39 5.85 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.394 -0.817 . . . . 0.0 110.288 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -73.84 142.36 46.11 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.179 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.487 HD12 ' OE2' ' A' ' 21' ' ' GLU . 1.1 mt -125.53 -170.82 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.353 -0.842 . . . . 0.0 110.211 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -74.17 116.69 15.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.375 -0.828 . . . . 0.0 110.203 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.92 -31.5 35.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.869 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.9 t60 . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.171 0.51 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.573 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -77.94 -41.46 36.24 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 2' ' ' MET . 5.1 tp 80.91 39.45 0.07 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.69 -39.72 77.2 Favored Glycine 0 N--CA 1.481 1.689 0 N-CA-C 109.815 -1.314 . . . . 0.0 109.815 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 52.39 89.82 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.343 -1.092 . . . . 0.0 110.426 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -132.26 -169.99 12.43 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.29 35.96 1.4 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.39 -1.065 . . . . 0.0 110.158 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.02 -37.02 2.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.372 -0.83 . . . . 0.0 110.345 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -55.69 -44.7 77.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.234 -0.916 . . . . 0.0 110.32 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -115.56 93.55 4.32 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.362 -0.836 . . . . 0.0 109.976 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.94 52.98 0.75 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.319 -0.863 . . . . 0.0 110.389 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 51.92 29.06 5.67 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.334 -0.854 . . . . 0.0 110.434 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -126.33 32.39 3.76 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.508 HG23 ' N ' ' A' ' 15' ' ' ASP . 34.9 m -139.9 -41.1 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.355 -1.085 . . . . 0.0 110.463 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 17' ' ' SER . 28.9 p30 -139.26 163.87 42.79 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.201 -0.937 . . . . 0.0 109.826 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.495 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 35.3 Cg_endo -57.89 72.91 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.879 1.462 . . . . 0.0 111.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.2 p 63.2 33.42 14.32 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-O 121.585 0.707 . . . . 0.0 109.409 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 17' ' ' SER . . . 38.15 33.78 0.06 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.266 0.555 . . . . 0.0 111.264 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.84 118.47 0.54 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.45 -0.782 . . . . 0.0 109.884 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.44 -14.95 34.44 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 O-C-N 123.937 1.493 . . . . 0.0 110.199 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 22' ' ' LEU . 9.9 pt-20 -76.57 -28.48 56.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.349 -0.845 . . . . 0.0 109.692 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.43 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 29.2 mt -90.59 -27.01 19.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.499 -0.75 . . . . 0.0 109.558 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.495 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -71.33 -35.03 71.07 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.366 -0.834 . . . . 0.0 109.648 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.644 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.2 mt -84.37 -31.23 24.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.358 -0.839 . . . . 0.0 109.567 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.19 -34.97 75.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.473 -0.767 . . . . 0.0 109.764 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp -83.28 -23.14 32.77 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -81.6 -31.15 32.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.275 -0.891 . . . . 0.0 109.393 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 24' ' ' LEU . 63.9 t -82.37 -25.33 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 O-C-N 121.613 -0.679 . . . . 0.0 109.814 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.4 t -80.03 -47.43 14.9 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 110.267 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 31.5 mtp -67.28 -31.09 71.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.413 -0.804 . . . . 0.0 110.281 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -73.04 -36.42 66.92 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.387 -0.821 . . . . 0.0 110.242 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.93 -39.45 76.11 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.861 . . . . 0.0 110.017 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -66.35 -27.64 68.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.418 -0.801 . . . . 0.0 110.086 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -75.1 -47.11 30.33 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.329 -0.857 . . . . 0.0 110.176 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -59.86 -25.94 65.45 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.278 -0.889 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -83.06 -48.05 11.01 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.336 -0.853 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.552 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.5 mm-40 -75.74 -21.95 57.0 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.384 -0.822 . . . . 0.0 110.373 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -83.96 -57.4 3.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.294 -0.879 . . . . 0.0 109.73 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -52.58 -32.54 41.65 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.382 -0.824 . . . . 0.0 109.19 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -84.18 -36.63 22.7 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.598 -0.688 . . . . 0.0 109.673 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.53 -56.45 6.53 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.974 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -57.19 -42.52 81.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.47 -0.769 . . . . 0.0 110.384 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 28.6 ttm180 -57.23 -33.76 67.89 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.263 -0.898 . . . . 0.0 110.049 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.56 -27.87 61.56 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.379 -0.825 . . . . 0.0 109.826 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.63 -24.74 56.48 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.462 -0.774 . . . . 0.0 110.081 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.23 -44.96 11.74 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.337 -0.852 . . . . 0.0 110.205 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.64 -35.96 82.31 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.371 -0.83 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 t -77.68 -30.92 52.22 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.436 -0.79 . . . . 0.0 110.273 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.92 -32.32 61.76 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.219 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.78 -27.72 50.3 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 110.283 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -68.25 -27.7 66.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.286 -0.884 . . . . 0.0 110.286 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.09 -28.16 15.23 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.246 -0.909 . . . . 0.0 110.263 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -92.76 -49.85 2.63 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.0 mm -117.18 96.71 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.323 -1.104 . . . . 0.0 110.159 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -167.88 -62.94 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.459 -0.775 . . . . 0.0 110.258 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.2 p -121.19 108.59 13.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.383 -0.823 . . . . 0.0 110.199 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.4 m -133.85 -53.96 0.87 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.247 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.93 50.96 0.27 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.0 m -130.08 102.39 6.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.382 -1.069 . . . . 0.0 110.268 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -132.21 61.26 1.66 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 110.244 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -97.26 -34.57 11.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.39 -0.818 . . . . 0.0 110.298 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.51 75.9 1.15 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.329 -0.857 . . . . 0.0 110.23 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -59.14 2.9 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.317 -0.864 . . . . 0.0 110.191 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -74.77 -27.5 60.36 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.215 -0.928 . . . . 0.0 109.175 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.37 -43.84 97.88 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.874 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.95 -29.15 69.5 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.2 tt -77.42 -36.84 52.8 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.529 -0.732 . . . . 0.0 109.866 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.3 -54.77 4.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.399 -0.813 . . . . 0.0 110.499 -179.733 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.7 mmt -54.44 -43.05 71.25 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.148 -0.97 . . . . 0.0 110.627 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.5 m -69.62 -40.4 76.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.272 -0.892 . . . . 0.0 110.621 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.409 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.0 tp -82.17 -15.96 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.154 -0.966 . . . . 0.0 110.221 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 68' ' ' LYS . 27.5 t -74.77 -42.89 57.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.876 . . . . 0.0 109.791 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -79.25 -27.02 42.35 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.528 -0.733 . . . . 0.0 109.977 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -83.14 -50.16 8.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.389 -0.819 . . . . 0.0 110.017 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -60.59 -33.35 72.6 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.372 -0.83 . . . . 0.0 110.049 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -63.63 -31.01 72.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.429 -0.794 . . . . 0.0 110.25 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.34 -27.96 71.55 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 132.95 40.77 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.344 -1.092 . . . . 0.0 110.263 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.8 m -151.28 27.36 0.68 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.292 -0.88 . . . . 0.0 110.181 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -88.35 54.78 4.21 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.0 149.2 1.46 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.425 -1.044 . . . . 0.0 108.856 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -71.03 64.64 2.56 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.59 1.31 . . . . 0.0 110.29 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -56.4 111.01 0.87 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.481 -0.762 . . . . 0.0 110.406 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 mt -80.05 -26.3 39.78 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.409 -0.807 . . . . 0.0 110.286 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.4 p -68.0 -15.66 63.7 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.312 -0.867 . . . . 0.0 110.407 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.9 m -118.2 22.06 12.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.184 -0.948 . . . . 0.0 110.09 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.4 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 43.2 mtt -128.88 123.4 32.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.393 -0.817 . . . . 0.0 109.98 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.8 p -77.5 -163.08 0.35 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.423 -0.798 . . . . 0.0 110.401 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.3 pt-20 -68.52 -31.68 71.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.521 -0.737 . . . . 0.0 109.196 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.4 mt-10 -85.57 -40.04 16.72 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.25 -44.73 94.32 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.4 ' HG3' ' HB3' ' A' ' 87' ' ' MET . 70.3 mt-30 -67.35 -34.18 76.78 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 178.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -66.38 -34.86 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.73 -46.0 90.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.514 -0.741 . . . . 0.0 110.238 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -40.19 29.87 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.367 -0.833 . . . . 0.0 109.949 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.91 79.21 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.349 -0.844 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 tpp -83.88 -24.39 30.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.361 -0.837 . . . . 0.0 110.097 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.44 -28.62 66.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.298 -0.876 . . . . 0.0 110.228 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.8 mmm -93.96 -27.34 16.4 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.381 -0.824 . . . . 0.0 110.166 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -33.11 64.94 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.315 -0.866 . . . . 0.0 110.202 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.7 mt -72.08 -27.06 62.42 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.344 -0.848 . . . . 0.0 110.206 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -104.91 14.0 30.19 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.37 -0.831 . . . . 0.0 110.489 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -138.7 78.81 0.3 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -84.08 79.34 9.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.377 -1.072 . . . . 0.0 110.176 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -101.75 -32.22 10.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.357 -0.839 . . . . 0.0 110.134 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.403 ' O ' ' CG ' ' A' ' 106' ' ' PHE . 59.2 t80 -113.84 35.65 4.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.357 -0.84 . . . . 0.0 110.157 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.12 133.58 36.64 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -83.42 64.59 7.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.3 -1.118 . . . . 0.0 110.177 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -92.49 -37.87 12.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.354 -0.841 . . . . 0.0 110.303 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.48 62.89 2.53 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.357 -0.839 . . . . 0.0 110.26 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.7 t -116.21 81.0 1.54 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.357 -0.84 . . . . 0.0 110.192 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.192 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.333 0.587 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -98.2 147.6 24.44 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.136 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.691 HD13 HG21 ' B' ' 17' ' ' VAL . 34.7 pt -137.63 157.72 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.334 -0.854 . . . . 0.0 110.076 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.41 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 80.5 m-85 -111.94 143.08 43.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.588 -0.695 . . . . 0.0 110.663 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' B' ' 12' ' ' THR . 95.7 t -127.83 119.74 52.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.49 -0.756 . . . . 0.0 109.455 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 18.7 mttt -100.08 136.75 39.5 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.409 -0.807 . . . . 0.0 110.743 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 73.4 p -96.17 171.13 8.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.437 -0.789 . . . . 0.0 110.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.82 -10.49 9.23 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.397 -0.814 . . . . 0.0 111.24 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.5 p -95.55 -18.49 20.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.933 -1.105 . . . . 0.0 110.631 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.99 7.4 25.23 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 9.5 tttt -84.61 129.87 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.083 -1.245 . . . . 0.0 109.811 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 7.5 m -113.14 126.1 55.07 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.305 -0.872 . . . . 0.0 110.232 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.4 mt -109.23 136.21 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.432 -0.792 . . . . 0.0 110.489 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.41 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 19.2 m -102.41 119.78 39.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.457 -0.777 . . . . 0.0 109.409 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.422 HD11 HG12 ' B' ' 30' ' ' ILE . 80.3 mt -123.51 166.85 14.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -106.52 114.31 28.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.804 . . . . 0.0 109.48 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.691 HG21 HD13 ' B' ' 3' ' ' ILE . 33.8 m -140.52 169.34 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 110.951 -179.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.427 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.0 OUTLIER -112.61 165.12 13.72 Favored Pre-proline 0 N--CA 1.488 1.474 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -71.67 -24.73 21.44 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.466 1.245 . . . . 0.0 110.375 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.45 -5.67 59.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.909 . . . . 0.0 110.531 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -71.24 143.48 50.4 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.265 -0.897 . . . . 0.0 110.721 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.4 p -83.3 159.52 21.89 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.588 -0.695 . . . . 0.0 110.391 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.585 HG23 HD12 ' B' ' 43' ' ' LEU . 43.5 mm -59.64 -36.33 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 109.647 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -60.83 -35.91 77.73 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 109.424 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -70.29 -33.15 71.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.538 -0.726 . . . . 0.0 109.393 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.1 t -70.15 -39.74 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.172 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -62.86 -43.49 98.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.475 -0.766 . . . . 0.0 109.166 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.35 -32.98 72.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.509 -0.744 . . . . 0.0 109.309 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.549 ' CD ' HG12 ' B' ' 17' ' ' VAL . 34.9 mttm -68.28 -39.36 82.17 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.479 -0.763 . . . . 0.0 109.473 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.422 HG12 HD11 ' B' ' 15' ' ' LEU . 10.2 mt -67.26 -38.69 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.369 -0.832 . . . . 0.0 109.09 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.5 OUTLIER -60.53 -50.67 72.64 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.491 179.108 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.19 -26.7 63.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.404 -0.81 . . . . 0.0 110.33 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.9 mmtm -83.85 -40.91 18.08 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.287 -0.883 . . . . 0.0 110.801 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -108.08 -55.57 2.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.244 -0.91 . . . . 0.0 110.449 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.36 18.59 1.82 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.479 HG23 ' HD2' ' B' ' 37' ' ' PRO . 18.3 mt -91.31 143.52 28.4 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.071 -1.252 . . . . 0.0 109.69 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.479 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -68.0 133.84 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 O-C-N 123.65 1.342 . . . . 0.0 110.387 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.91 -26.48 83.19 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.65 1.342 . . . . 0.0 110.756 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.0 64.16 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.325 -0.86 . . . . 0.0 110.061 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 23.1 mt-30 -101.23 -0.9 35.01 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.37 -0.831 . . . . 0.0 110.629 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -94.17 140.39 29.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.163 -0.96 . . . . 0.0 110.243 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -130.08 130.43 44.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.457 -0.777 . . . . 0.0 109.956 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.923 ' HB3' HD12 ' B' ' 50' ' ' LEU . 23.1 mt -104.59 116.91 32.9 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.404 -0.81 . . . . 0.0 110.441 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.782 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.7 mp -121.16 134.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.493 -0.754 . . . . 0.0 109.862 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.558 ' HB2' HD23 ' B' ' 67' ' ' LEU . 57.5 t80 -140.8 152.5 45.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.469 -0.77 . . . . 0.0 109.941 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.18 27.76 0.35 Allowed 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.492 -0.755 . . . . 0.0 111.25 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.03 1.64 80.09 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -110.79 137.27 48.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.044 -1.268 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -78.6 135.72 37.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.358 -0.838 . . . . 0.0 109.9 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.923 HD12 ' HB3' ' B' ' 43' ' ' LEU . 51.3 mt -83.83 138.4 33.23 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.384 -0.822 . . . . 0.0 110.123 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -93.64 131.02 39.34 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 110.422 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 64.3 m-20 -48.34 -27.6 2.65 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.484 -0.76 . . . . 0.0 111.059 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -7.98 86.47 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.2 mmt-85 -99.36 155.87 17.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.007 -1.29 . . . . 0.0 110.442 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 34.9 p -102.51 163.47 12.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.419 -0.8 . . . . 0.0 110.185 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.556 ' HA ' HD12 ' B' ' 61' ' ' ILE . 98.0 mt -53.49 -44.48 69.05 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.338 -0.851 . . . . 0.0 110.635 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 60.0 p -56.94 -36.85 70.73 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.333 -0.854 . . . . 0.0 110.986 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.52 -27.68 66.4 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.173 -0.955 . . . . 0.0 110.257 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.665 ' CD2' HD22 ' B' ' 50' ' ' LEU . 58.2 m-85 -100.95 27.74 5.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.406 -0.809 . . . . 0.0 109.803 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 m120 50.74 28.33 3.54 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.544 -0.723 . . . . 0.0 110.673 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.556 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.5 mt -81.56 108.64 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.403 -0.811 . . . . 0.0 109.96 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -105.65 173.35 6.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.358 -0.839 . . . . 0.0 110.197 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 4.4 pttt -46.6 152.71 0.44 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.462 -0.774 . . . . 0.0 110.958 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.5 mt-10 62.67 16.49 8.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.593 -0.692 . . . . 0.0 110.555 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.58 144.97 49.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.259 -0.901 . . . . 0.0 110.117 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.9 m -107.54 107.9 18.95 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.331 -0.856 . . . . 0.0 109.919 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.558 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.3 mt -102.39 160.62 14.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.116 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -108.83 134.49 51.45 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.293 -0.88 . . . . 0.0 110.027 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.8 tp -107.21 133.73 51.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.246 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 41.4 t -125.04 152.55 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.443 -0.786 . . . . 0.0 110.293 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mt -94.46 114.83 26.9 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.503 -0.748 . . . . 0.0 110.128 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.416 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 2.9 tmt_? -83.77 78.29 9.73 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.288 -0.883 . . . . 0.0 110.17 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -99.8 129.78 45.94 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.403 -0.811 . . . . 0.0 110.24 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -138.35 69.9 1.38 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.333 -0.854 . . . . 0.0 110.172 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 147.14 84.27 0.05 OUTLIER Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.011 -1.438 . . . . 0.0 109.621 -179.913 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.182 0.515 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.567 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.2 OUTLIER -160.69 -65.31 0.06 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 110.198 -179.948 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.567 ' CB ' ' O ' ' A' ' 2' ' ' MET . 5.1 tp 80.66 39.93 0.07 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.91 60.73 3.78 Favored Glycine 0 N--CA 1.482 1.766 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 -179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -168.23 31.13 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.316 -1.109 . . . . 0.0 110.231 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -119.32 -55.28 0.26 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.59 26.95 9.5 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.362 -1.081 . . . . 0.0 110.159 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 75.6 m -129.42 17.85 5.9 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.412 -0.805 . . . . 0.0 110.4 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -103.42 -18.0 15.0 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.283 -0.885 . . . . 0.0 110.306 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' CE1' ' NH2' ' B' ' 72' ' ' ARG . 29.0 m-85 -101.68 -27.87 12.81 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.272 -0.893 . . . . 0.0 110.202 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.39 38.24 1.45 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.406 -0.808 . . . . 0.0 110.199 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.91 -44.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.372 -0.83 . . . . 0.0 110.164 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.94 -38.03 60.33 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 31.7 m -114.89 -27.54 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.346 -1.091 . . . . 0.0 110.313 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 58.85 173.01 0.05 OUTLIER Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.932 . . . . 0.0 109.945 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.91 -19.24 40.53 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 O-C-N 123.653 1.343 . . . . 0.0 110.412 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.0 t -73.62 -13.98 61.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.406 -0.808 . . . . 0.0 110.391 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 14' ' ' VAL . . . -92.82 -13.15 29.49 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.221 -0.924 . . . . 0.0 110.455 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.422 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 45.8 m-20 -147.79 110.49 3.84 Favored Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.894 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 19' ' ' ASP . 51.8 Cg_endo -71.22 -9.52 25.59 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.02 1.537 . . . . 0.0 110.631 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -79.49 -31.64 42.33 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 109.116 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.451 ' C ' HD23 ' A' ' 22' ' ' LEU . 4.3 tt -88.47 -28.21 20.99 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.531 -0.731 . . . . 0.0 109.346 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.672 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.2 mm? -82.36 -34.68 28.35 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 109.565 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.88 -32.49 74.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.374 -0.829 . . . . 0.0 109.7 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.869 ' O ' HD13 ' A' ' 26' ' ' LEU . 2.8 tm? -82.99 -25.67 32.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.484 -0.76 . . . . 0.0 110.064 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -84.43 -33.29 23.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.88 . . . . 0.0 109.642 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 24' ' ' LEU . 96.4 t -75.31 -30.84 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.554 -0.716 . . . . 0.0 109.788 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.1 m -77.6 -38.15 48.77 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.396 -0.815 . . . . 0.0 110.051 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.0 tpt -63.49 -46.55 85.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.442 -0.786 . . . . 0.0 110.005 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -65.84 -34.44 78.16 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.335 -0.853 . . . . 0.0 110.124 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.58 -45.81 88.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.276 -0.89 . . . . 0.0 109.959 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -62.04 -28.56 69.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.408 -0.807 . . . . 0.0 110.148 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -47.68 32.69 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.119 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.55 -47.11 80.16 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.474 -0.766 . . . . 0.0 110.134 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -49.47 75.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.365 -0.834 . . . . 0.0 110.101 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.584 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.5 mt-30 -69.42 -22.48 63.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.343 -0.848 . . . . 0.0 110.225 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.54 -57.43 3.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 109.666 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -52.36 -30.2 27.64 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.794 . . . . 0.0 109.202 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -88.03 -34.17 18.09 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.584 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -65.21 -47.52 76.6 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.358 -0.839 . . . . 0.0 109.729 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.524 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 21.5 ptt180 -70.53 -34.17 71.98 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.469 -0.769 . . . . 0.0 109.796 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.2 mmt-85 -52.86 -42.8 65.57 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.39 -0.819 . . . . 0.0 109.219 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.9 -27.15 36.36 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.524 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -63.55 -28.51 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.562 -0.711 . . . . 0.0 109.739 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.67 -42.12 12.19 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.788 . . . . 0.0 110.049 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.09 -25.76 66.38 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.419 -0.8 . . . . 0.0 110.179 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.2 m -94.38 -32.62 13.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.346 -0.846 . . . . 0.0 110.236 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -67.92 -30.27 69.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.393 -0.817 . . . . 0.0 110.15 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.29 -23.05 65.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.396 -0.815 . . . . 0.0 110.337 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -111.25 -34.69 6.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.288 -0.882 . . . . 0.0 110.254 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -94.07 -37.29 11.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.354 -0.841 . . . . 0.0 110.213 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.36 -75.62 1.05 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 pt -125.84 -140.15 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.401 -1.058 . . . . 0.0 109.822 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.95 -175.5 4.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.091 -1.006 . . . . 0.0 110.21 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.1 m -143.46 151.23 40.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.411 -0.806 . . . . 0.0 110.209 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 57' ' ' THR . 5.2 t -143.34 82.77 1.76 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.377 -0.827 . . . . 0.0 110.16 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -134.64 27.79 3.18 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.6 m -106.86 55.38 0.66 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.344 -1.092 . . . . 0.0 110.139 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -83.74 80.59 9.08 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.322 -0.861 . . . . 0.0 110.207 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.56 -27.4 8.59 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.353 -0.842 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.22 77.74 1.66 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.822 . . . . 0.0 110.17 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.89 -53.04 7.93 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.369 -0.832 . . . . 0.0 110.229 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -74.34 -29.07 61.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.19 -0.944 . . . . 0.0 109.086 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.81 -44.41 96.9 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.54 -0.864 . . . . 0.0 108.928 179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 17.1 mt -64.73 -28.85 69.87 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 tt -75.11 -47.54 28.15 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.522 -0.736 . . . . 0.0 109.842 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.95 -53.55 7.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.33 -0.856 . . . . 0.0 110.527 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -51.98 -39.6 59.59 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.177 -0.952 . . . . 0.0 110.714 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 34.3 m -69.2 -43.33 74.37 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.17 -12.65 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.136 -0.978 . . . . 0.0 110.332 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.53 -41.71 45.74 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -0.879 . . . . 0.0 109.79 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -84.28 -23.02 30.53 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.416 -0.803 . . . . 0.0 110.249 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -87.47 -40.19 14.56 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.344 -0.848 . . . . 0.0 110.422 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -75.33 -29.57 60.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.197 -0.939 . . . . 0.0 110.243 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -59.53 109.72 0.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.354 -0.841 . . . . 0.0 110.186 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -146.56 -67.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -92.0 -28.92 16.9 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.278 -1.131 . . . . 0.0 110.312 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.644 HG22 ' O ' ' A' ' 79' ' ' THR . 90.7 m 52.45 28.99 6.42 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.393 -0.817 . . . . 0.0 110.338 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.568 ' C ' HD23 ' A' ' 81' ' ' LEU . . . -92.73 24.88 21.68 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.568 HD23 ' C ' ' A' ' 80' ' ' GLY . 0.4 OUTLIER -173.08 147.38 1.5 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.244 -1.15 . . . . 0.0 108.902 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -75.56 38.75 0.58 Allowed 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 123.506 1.266 . . . . 0.0 110.719 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 50.15 76.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.228 -0.92 . . . . 0.0 110.553 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.2 mt -79.32 -27.87 42.13 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.372 -0.83 . . . . 0.0 110.333 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -25.7 62.15 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.283 -0.886 . . . . 0.0 110.288 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.0 p -83.86 -37.57 22.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.358 -0.839 . . . . 0.0 110.106 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 15.0 mtm -81.44 121.05 25.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.384 -0.822 . . . . 0.0 110.139 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 70.6 p -77.54 -164.55 0.5 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.304 -0.872 . . . . 0.0 110.426 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.563 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.5 pt-20 -67.61 -30.99 70.72 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.558 -0.713 . . . . 0.0 109.126 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.446 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 65.6 mt-10 -85.31 -40.67 16.3 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.75 -42.16 99.54 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -70.47 -35.62 73.41 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.563 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.33 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.02 -41.23 96.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.484 -0.76 . . . . 0.0 109.624 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -74.05 -51.82 14.6 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.495 -0.753 . . . . 0.0 110.147 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.92 -37.65 80.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.453 -0.779 . . . . 0.0 110.358 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 tpt -81.57 -20.13 40.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.313 -0.867 . . . . 0.0 110.103 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -69.34 -30.56 68.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.28 -0.888 . . . . 0.0 110.088 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 69.7 mtp -95.42 -21.84 18.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.35 -0.844 . . . . 0.0 110.473 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.4 m -79.64 -37.56 35.73 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.261 -0.899 . . . . 0.0 110.418 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.98 -35.23 78.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.273 -0.892 . . . . 0.0 110.182 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -84.37 -64.44 1.16 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.442 -0.786 . . . . 0.0 110.228 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 116.68 -95.71 0.69 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.539 -1.425 . . . . 0.0 109.539 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -165.87 112.92 0.91 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.378 -1.072 . . . . 0.0 110.242 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -125.73 33.35 5.11 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.302 -0.874 . . . . 0.0 110.257 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -147.68 -62.76 0.27 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 97.73 55.28 1.16 Allowed Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -129.82 -149.48 0.4 Allowed 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.376 -1.073 . . . . 0.0 109.617 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -89.33 0.59 56.7 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.381 -0.825 . . . . 0.0 110.595 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 51.97 61.51 3.17 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.519 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.8 m -153.84 113.82 3.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.381 -0.824 . . . . 0.0 110.216 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.184 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.313 0.578 . . . . 0.0 110.349 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -119.08 137.9 53.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.512 -0.742 . . . . 0.0 109.508 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.461 HD13 HG21 ' B' ' 17' ' ' VAL . 40.1 pt -137.66 157.97 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -0.967 . . . . 0.0 110.626 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' B' ' 14' ' ' THR . 66.3 m-85 -111.91 146.85 37.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.604 -0.685 . . . . 0.0 110.364 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.488 HG11 HD11 ' B' ' 30' ' ' ILE . 66.3 t -127.78 116.55 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 109.598 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.0 136.85 39.29 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.545 -179.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.7 p -96.02 168.3 10.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.444 -0.785 . . . . 0.0 110.063 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 17.0 mt -61.8 -8.84 5.34 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.315 -0.866 . . . . 0.0 111.29 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 47.7 p -95.43 -19.74 19.64 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.079 -1.013 . . . . 0.0 110.597 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 113.31 6.23 22.24 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 10.5 tttp -84.66 129.7 34.8 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.093 -1.239 . . . . 0.0 109.968 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 14.6 m -113.21 128.73 56.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.084 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 38.4 mt -109.28 141.19 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.504 -0.748 . . . . 0.0 110.406 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.422 HG23 ' CE1' ' B' ' 4' ' ' PHE . 27.6 m -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.366 -0.834 . . . . 0.0 109.176 179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.414 ' CD2' ' CE ' ' B' ' 33' ' ' LYS . 35.0 mt -123.42 154.35 39.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.12 -0.987 . . . . 0.0 111.137 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -106.32 114.98 29.43 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.443 -0.786 . . . . 0.0 109.034 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.468 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.4 m -140.01 176.76 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.248 -0.908 . . . . 0.0 111.039 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.403 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.1 mp0 -113.19 166.87 10.22 Favored Pre-proline 0 N--CA 1.487 1.408 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.88 -25.73 19.62 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 O-C-N 123.493 1.26 . . . . 0.0 110.192 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.82 -1.9 57.03 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.171 -0.956 . . . . 0.0 110.552 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -71.19 140.57 50.54 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.123 -0.986 . . . . 0.0 110.567 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.9 p -83.62 159.2 21.64 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 110.763 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.629 HG23 HD12 ' B' ' 43' ' ' LEU . 44.1 mm -59.71 -40.57 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.42 -0.8 . . . . 0.0 109.621 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -56.85 -34.58 67.95 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.332 -0.855 . . . . 0.0 109.579 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -70.59 -33.6 71.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.514 -0.741 . . . . 0.0 109.329 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 82.0 t -69.91 -40.22 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.415 -0.803 . . . . 0.0 109.186 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -62.86 -41.32 99.32 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.419 -0.801 . . . . 0.0 109.083 179.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.77 74.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.537 -0.727 . . . . 0.0 109.297 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.414 ' CE ' HG12 ' B' ' 17' ' ' VAL . 6.0 mttm -68.07 -40.5 82.71 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.535 -0.728 . . . . 0.0 109.555 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.75 HD13 HD12 ' B' ' 69' ' ' LEU . 36.8 mt -66.78 -37.34 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.312 -0.868 . . . . 0.0 109.115 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -60.55 -47.71 84.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.418 -0.801 . . . . 0.0 109.254 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.44 -31.67 67.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.508 -0.745 . . . . 0.0 110.613 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.414 ' CE ' ' CD2' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -83.42 -36.96 23.84 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.293 -0.879 . . . . 0.0 111.262 -179.312 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -108.11 -55.86 2.32 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.106 -0.996 . . . . 0.0 110.55 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 125.88 15.37 2.9 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.474 HG23 ' HD2' ' B' ' 37' ' ' PRO . 90.6 mt -91.25 142.95 27.63 Favored Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.154 -1.203 . . . . 0.0 109.749 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.495 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.6 Cg_endo -68.22 134.79 32.43 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.638 1.336 . . . . 0.0 110.622 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.91 -25.64 81.72 Favored 'Trans proline' 0 C--N 1.313 -1.318 0 O-C-N 123.695 1.366 . . . . 0.0 111.012 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.68 -22.01 64.4 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 109.902 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.495 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.2 mp0 -101.01 -4.25 27.83 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.454 -0.779 . . . . 0.0 110.513 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -94.26 142.5 27.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.198 -0.939 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.07 130.99 45.59 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.421 -0.799 . . . . 0.0 109.725 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.81 ' HB3' HD12 ' B' ' 50' ' ' LEU . 24.5 mt -104.64 118.72 37.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.244 -0.91 . . . . 0.0 110.448 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.779 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.32 135.37 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.405 -0.81 . . . . 0.0 109.723 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.613 ' HB2' HD23 ' B' ' 67' ' ' LEU . 78.9 t80 -140.72 150.49 43.51 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.453 -0.779 . . . . 0.0 110.053 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.28 28.01 0.4 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.482 -0.761 . . . . 0.0 111.253 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.409 ' CA ' HD22 ' A' ' 26' ' ' LEU . . . 78.77 1.97 84.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 136.65 49.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.084 -1.245 . . . . 0.0 110.178 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -78.41 135.17 37.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.831 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.81 HD12 ' HB3' ' B' ' 43' ' ' LEU . 49.1 mt -83.79 140.72 31.88 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.296 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.58 131.27 39.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.346 -0.846 . . . . 0.0 110.418 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.467 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 76.7 m-20 -48.3 -32.43 7.34 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.438 -0.789 . . . . 0.0 111.051 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.07 -2.69 90.6 Favored Glycine 0 N--CA 1.493 2.492 0 C-N-CA 120.132 -1.032 . . . . 0.0 110.599 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.446 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.8 mmt85 -99.47 153.34 19.1 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.038 -1.272 . . . . 0.0 110.445 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.532 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 82.6 p -102.2 164.63 11.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.451 -0.781 . . . . 0.0 110.174 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.505 HD22 HG21 ' B' ' 61' ' ' ILE . 65.8 mt -53.49 -44.82 69.35 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.28 -0.887 . . . . 0.0 110.743 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 42.3 t -56.62 -35.55 68.43 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.371 -0.831 . . . . 0.0 111.02 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -59.71 -28.98 67.79 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.296 -0.878 . . . . 0.0 110.407 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.638 ' CD2' HD22 ' B' ' 50' ' ' LEU . 64.3 m-85 -100.94 24.57 9.1 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.332 -0.855 . . . . 0.0 110.228 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 50.64 30.76 5.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.489 -0.757 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.505 HG21 HD22 ' B' ' 56' ' ' LEU . 86.1 mt -81.4 114.37 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.409 -0.807 . . . . 0.0 109.926 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -105.77 171.13 7.5 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.372 -0.83 . . . . 0.0 110.275 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.443 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.1 OUTLIER -46.62 155.11 0.26 Allowed 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.548 -0.72 . . . . 0.0 111.128 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 63.38 13.11 6.8 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.702 -0.624 . . . . 0.0 111.003 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.9 141.38 49.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 58.7 m -107.4 115.08 29.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.321 -0.862 . . . . 0.0 109.942 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.613 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.7 mt -102.44 161.13 13.95 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -0.856 . . . . 0.0 110.378 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -108.76 136.79 47.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.312 -0.868 . . . . 0.0 109.806 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.75 HD12 HD13 ' B' ' 30' ' ' ILE . 6.9 tt -107.31 135.96 47.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.176 -0.952 . . . . 0.0 110.466 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.68 ' N ' HD23 ' B' ' 69' ' ' LEU . 47.8 t -125.08 155.97 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.488 -0.758 . . . . 0.0 110.048 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 25.6 mt -94.06 106.5 18.47 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.325 -0.86 . . . . 0.0 110.353 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.452 ' NH2' ' CE1' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -85.72 86.11 7.38 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.358 -0.838 . . . . 0.0 110.14 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 58.46 164.81 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.409 -0.807 . . . . 0.0 110.354 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -170.05 145.78 2.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.351 -0.843 . . . . 0.0 110.237 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 123.37 -105.09 0.89 Allowed Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 CA-C-O 118.017 -1.435 . . . . 0.0 109.517 179.958 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.223 0.535 . . . . 0.0 110.237 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.99 -169.27 2.76 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.34 -0.85 . . . . 0.0 110.245 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mp -112.0 24.48 12.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.444 -0.785 . . . . 0.0 109.654 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.08 66.58 2.51 Favored Glycine 0 N--CA 1.488 2.137 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -147.83 60.47 1.13 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.304 -1.115 . . . . 0.0 110.226 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -168.11 166.65 39.62 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.11 -27.81 8.23 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.44 -1.035 . . . . 0.0 110.221 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.56 -25.96 67.64 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.863 . . . . 0.0 110.285 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -59.4 -29.13 67.52 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.292 -0.88 . . . . 0.0 110.268 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.905 ' CD2' HG21 ' A' ' 14' ' ' VAL . 0.1 OUTLIER -134.58 106.86 7.2 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.476 -0.765 . . . . 0.0 110.087 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.708 ' O ' HG22 ' A' ' 14' ' ' VAL . 1.5 tt0 -54.05 143.54 21.85 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.373 -0.83 . . . . 0.0 109.796 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.461 ' CD1' ' N ' ' A' ' 12' ' ' PHE . 10.5 m-30 -59.72 -14.81 15.89 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.275 -0.89 . . . . 0.0 110.74 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -90.73 -3.89 70.55 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.905 HG21 ' CD2' ' A' ' 10' ' ' PHE . 35.6 m -57.12 -26.45 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.048 -1.266 . . . . 0.0 110.398 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -160.21 153.67 18.8 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.342 -0.849 . . . . 0.0 110.173 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.57 -15.11 30.72 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.846 1.446 . . . . 0.0 110.733 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.46 -9.74 58.66 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.294 -0.879 . . . . 0.0 110.588 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -24.41 55.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.12 -0.987 . . . . 0.0 110.292 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.59 120.3 0.59 Allowed Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.351 -0.843 . . . . 0.0 109.853 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -70.19 -15.34 35.46 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 123.948 1.499 . . . . 0.0 110.111 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -75.95 -31.87 59.27 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.43 -0.794 . . . . 0.0 109.37 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.45 -28.86 28.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.598 -0.689 . . . . 0.0 109.293 179.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.72 -37.98 67.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.474 -0.766 . . . . 0.0 109.573 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.547 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -81.55 -36.72 28.78 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.444 -0.785 . . . . 0.0 109.733 179.612 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.19 -32.43 72.66 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.324 -0.86 . . . . 0.0 109.945 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.5 tp -83.0 -21.86 33.8 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.275 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.22 -32.49 29.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.263 -0.898 . . . . 0.0 109.159 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 24' ' ' LEU . 66.7 t -80.42 -27.84 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 O-C-N 121.63 -0.669 . . . . 0.0 109.601 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -77.12 -33.91 56.74 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.8 ttm -74.65 -35.09 62.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 110.028 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.48 -29.9 59.72 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 110.204 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -50.4 21.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.347 -0.845 . . . . 0.0 110.083 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -60.46 -28.35 68.26 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.389 -0.819 . . . . 0.0 110.196 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -46.83 52.77 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.465 -0.772 . . . . 0.0 110.073 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -62.34 -31.05 71.63 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -81.76 -52.95 6.62 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.35 -0.844 . . . . 0.0 110.115 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.674 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 10.1 mm-40 -60.04 -25.43 65.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.481 -0.762 . . . . 0.0 110.284 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -83.71 -57.26 3.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.494 -0.754 . . . . 0.0 109.577 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -52.54 -35.99 54.62 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.49 -0.756 . . . . 0.0 109.14 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -80.25 -34.28 37.26 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.79 -51.11 66.28 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.428 -0.795 . . . . 0.0 109.585 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -70.8 -30.11 66.47 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.466 -0.771 . . . . 0.0 109.617 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -53.57 -39.31 64.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.359 -0.838 . . . . 0.0 109.171 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.36 -25.27 36.47 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.663 -0.648 . . . . 0.0 109.293 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.35 65.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.488 -0.758 . . . . 0.0 109.81 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.61 -41.97 13.83 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.47 -0.769 . . . . 0.0 110.085 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -26.84 68.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.208 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.3 -33.5 15.3 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.339 -0.851 . . . . 0.0 110.205 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.69 -29.24 66.62 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.407 -0.808 . . . . 0.0 110.18 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.73 -17.49 63.46 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.424 -0.797 . . . . 0.0 110.4 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -96.23 -37.43 10.54 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.31 -0.869 . . . . 0.0 110.292 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 -33.01 18.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.391 -0.818 . . . . 0.0 110.249 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.41 -56.74 4.96 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.631 HG23 ' O ' ' A' ' 54' ' ' ILE . 5.2 tp -125.8 97.02 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.419 -1.048 . . . . 0.0 110.292 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.26 -25.85 18.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.883 . . . . 0.0 110.266 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.2 p -59.91 105.41 0.38 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.345 -0.847 . . . . 0.0 110.198 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 30.9 m -158.82 -63.55 0.08 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.456 -0.777 . . . . 0.0 110.098 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -170.01 67.74 0.15 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 9.5 m -120.25 71.49 0.91 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -1.091 . . . . 0.0 110.254 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -81.46 76.23 8.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.346 -0.846 . . . . 0.0 110.141 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.59 -41.93 7.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 110.353 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.513 ' HB2' ' HB2' ' A' ' 65' ' ' ALA . 36.2 p -129.07 85.84 2.37 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.292 -0.88 . . . . 0.0 110.262 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -63.38 -32.04 73.36 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.399 -0.813 . . . . 0.0 110.268 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -74.96 -30.53 61.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.186 -0.947 . . . . 0.0 109.026 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.513 ' HB2' ' HB2' ' A' ' 62' ' ' SER . . . -60.27 -48.87 79.88 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.564 -0.855 . . . . 0.0 108.819 179.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.12 -29.89 68.92 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 tt -76.23 -35.33 59.06 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.497 0.665 . . . . 0.0 109.563 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 1.3 mttt -81.22 -58.0 3.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.427 -0.795 . . . . 0.0 110.289 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 mtt -51.0 -37.3 44.25 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.363 -0.836 . . . . 0.0 110.642 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.2 m -70.02 -44.47 69.24 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 110.261 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.5 tp -83.59 -11.67 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.208 -0.933 . . . . 0.0 110.437 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 3.4 m -77.33 -44.68 28.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.207 -0.933 . . . . 0.0 109.711 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.28 -24.29 37.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.523 -0.736 . . . . 0.0 110.019 179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.75 -34.08 22.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -75.63 -40.7 55.87 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.305 -0.872 . . . . 0.0 110.205 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.17 102.38 0.1 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.325 -0.859 . . . . 0.0 110.2 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.95 -83.45 0.16 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -91.29 116.8 29.12 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.346 -1.091 . . . . 0.0 110.139 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -121.43 41.32 3.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.322 -0.861 . . . . 0.0 110.158 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.92 24.05 32.64 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -172.69 150.08 2.06 Favored Pre-proline 0 N--CA 1.488 1.44 0 O-C-N 121.302 -1.116 . . . . 0.0 108.973 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.44 ' HG3' ' CE2' ' A' ' 95' ' ' TYR . 55.1 Cg_endo -76.29 38.77 0.62 Allowed 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.588 1.309 . . . . 0.0 110.874 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 50.42 82.69 0.05 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.145 -0.972 . . . . 0.0 110.592 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.46 HD23 ' HG2' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -90.5 -28.49 18.51 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.307 -0.871 . . . . 0.0 110.303 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.3 m -62.11 -16.58 53.48 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.369 -0.832 . . . . 0.0 110.566 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 77.7 p -106.16 -24.71 12.27 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.23 -0.919 . . . . 0.0 110.099 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.446 ' C ' HG23 ' A' ' 88' ' ' THR . 14.3 mtt -60.92 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.352 -0.843 . . . . 0.0 110.04 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.446 HG23 ' C ' ' A' ' 87' ' ' MET . 69.4 p -148.35 -170.66 3.65 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.373 -0.83 . . . . 0.0 110.166 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.599 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.15 -34.64 78.86 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.421 -0.799 . . . . 0.0 109.345 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.415 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.8 mt-10 -85.45 -40.19 16.68 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 120.13 -0.628 . . . . 0.0 109.6 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.411 ' HB2' ' OG1' ' A' ' 88' ' ' THR . 0.3 OUTLIER -65.11 -42.51 93.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 108.528 179.109 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.46 ' HG2' HD23 ' A' ' 84' ' ' LEU . 79.9 mt-30 -70.02 -34.01 72.73 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.599 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.68 -35.69 65.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.58 -45.52 75.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.585 -0.697 . . . . 0.0 109.551 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.44 ' CE2' ' HG3' ' A' ' 82' ' ' PRO . 9.1 t80 -67.08 -32.68 74.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.84 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.57 -34.64 35.17 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 110.064 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.565 ' O ' HD12 ' A' ' 101' ' ' LEU . 9.8 mmt -83.89 -26.28 29.53 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.297 -0.877 . . . . 0.0 109.907 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -76.95 -31.37 56.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.421 -0.799 . . . . 0.0 110.199 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.6 mmm -85.04 -27.78 26.13 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.391 -0.818 . . . . 0.0 110.209 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.93 -41.06 52.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.276 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.565 HD12 ' O ' ' A' ' 97' ' ' MET . 8.7 mt -73.49 -29.2 62.35 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.216 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -68.91 -47.75 65.02 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.314 -0.866 . . . . 0.0 110.236 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 177.08 103.46 0.17 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -95.17 61.78 2.46 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.386 -1.067 . . . . 0.0 110.155 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 52.01 81.81 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.348 -0.845 . . . . 0.0 110.518 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -160.32 44.39 0.2 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.37 -0.832 . . . . 0.0 110.133 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -145.91 85.84 0.17 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -149.12 84.2 1.45 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.364 -1.08 . . . . 0.0 110.258 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -143.9 54.46 1.31 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.294 -0.879 . . . . 0.0 110.211 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.44 53.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.827 . . . . 0.0 110.211 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.1 m -109.02 160.13 16.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.384 -0.822 . . . . 0.0 110.234 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.167 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.266 0.555 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -97.79 146.46 25.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.498 -0.751 . . . . 0.0 109.93 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.568 HD13 HG21 ' B' ' 17' ' ' VAL . 20.8 pt -137.56 159.03 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.34 -0.85 . . . . 0.0 110.269 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -111.93 142.25 44.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.527 -0.733 . . . . 0.0 110.545 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 57.5 t -127.53 117.91 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.399 -0.813 . . . . 0.0 109.602 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.4 mttm -100.2 130.5 46.34 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.411 -0.806 . . . . 0.0 110.599 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.542 HG22 ' HB3' ' B' ' 69' ' ' LEU . 61.2 p -96.01 175.26 6.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.394 -0.816 . . . . 0.0 110.001 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.433 HD11 HG13 ' B' ' 70' ' ' VAL . 12.7 mt -61.72 -11.31 11.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.251 -0.906 . . . . 0.0 111.039 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 62.9 p -95.72 13.82 25.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.962 -1.086 . . . . 0.0 110.791 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.64 7.84 70.36 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 21.6 tttm -84.83 130.05 34.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.985 -1.303 . . . . 0.0 109.919 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 41.7 m -113.33 125.58 54.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.359 -0.838 . . . . 0.0 110.245 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.4 mt -109.28 136.23 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.414 -0.804 . . . . 0.0 110.417 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.4 m -102.19 120.83 41.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.301 -0.875 . . . . 0.0 109.448 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.9 mt -123.64 168.84 12.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.129 -0.982 . . . . 0.0 110.919 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -106.27 113.71 27.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.472 -0.767 . . . . 0.0 109.492 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.568 HG21 HD13 ' B' ' 3' ' ' ILE . 32.3 m -140.68 167.22 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.279 -0.888 . . . . 0.0 110.958 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.55 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -112.69 167.24 9.49 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.535 -0.728 . . . . 0.0 109.06 178.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.94 -26.75 18.3 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.449 1.236 . . . . 0.0 110.39 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.5 -3.15 58.23 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.183 -0.948 . . . . 0.0 110.523 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.07 141.92 50.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.162 -0.961 . . . . 0.0 110.47 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.2 p -83.26 158.04 22.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.57 -0.706 . . . . 0.0 110.345 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.716 HG22 ' CE ' ' B' ' 27' ' ' LYS . 44.5 mm -59.71 -36.41 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.349 -0.844 . . . . 0.0 109.494 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -60.25 -35.38 75.37 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.23 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -31.79 68.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.461 -0.775 . . . . 0.0 109.19 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -70.11 -41.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.493 -0.754 . . . . 0.0 109.089 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.716 ' CE ' HG22 ' B' ' 23' ' ' ILE . 38.1 mttt -62.93 -42.87 99.94 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.476 -0.765 . . . . 0.0 109.34 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.24 -33.84 74.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.518 -0.739 . . . . 0.0 109.426 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.2 mttp -68.3 -39.29 82.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.506 -0.746 . . . . 0.0 109.558 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.409 HD13 HD22 ' B' ' 69' ' ' LEU . 10.5 mt -67.12 -38.96 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 119.669 -0.812 . . . . 0.0 109.18 179.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.65 -50.66 72.6 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.416 -0.802 . . . . 0.0 109.588 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -58.11 -25.89 61.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.315 -0.866 . . . . 0.0 110.375 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -84.01 -41.94 16.73 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.169 -0.957 . . . . 0.0 110.722 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -107.99 -54.51 2.49 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.16 -0.962 . . . . 0.0 110.502 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.45 21.45 1.81 Allowed Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.543 HG23 ' HD2' ' B' ' 37' ' ' PRO . 15.2 mt -91.45 145.2 30.89 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.131 -1.217 . . . . 0.0 109.797 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.543 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.8 Cg_endo -67.28 131.51 25.17 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.586 1.308 . . . . 0.0 110.4 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -60.73 -24.59 79.16 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.676 1.356 . . . . 0.0 110.741 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.74 -25.11 64.58 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 109.636 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -101.28 9.78 41.37 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.574 -0.703 . . . . 0.0 110.209 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . 0.412 ' HG2' HD11 ' B' ' 69' ' ' LEU . 0.5 OUTLIER -94.25 137.04 33.88 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.206 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH2' HD11 ' B' ' 44' ' ' ILE . 0.1 OUTLIER -130.04 123.48 30.6 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.351 -0.843 . . . . 0.0 110.1 179.857 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.79 ' C ' HD12 ' B' ' 44' ' ' ILE . 25.0 mt -104.52 115.26 30.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.383 -0.823 . . . . 0.0 110.236 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.79 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.12 137.01 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.515 -0.74 . . . . 0.0 109.727 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -140.65 145.65 36.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.43 -0.794 . . . . 0.0 109.82 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.41 29.27 0.56 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.504 -0.747 . . . . 0.0 111.062 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.3 6.43 87.8 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -111.09 131.6 54.95 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.051 -1.264 . . . . 0.0 110.238 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -78.59 131.68 36.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.257 -0.902 . . . . 0.0 109.615 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.641 HD22 ' CG ' ' B' ' 59' ' ' TYR . 26.1 mt -83.95 139.01 32.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.904 . . . . 0.0 110.351 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.71 132.43 38.08 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.319 -0.863 . . . . 0.0 110.775 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.468 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 7.8 m-20 -48.42 -28.38 3.22 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.519 -0.738 . . . . 0.0 111.104 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.95 -6.69 88.12 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.59 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 5.5 mmt-85 -99.38 156.27 17.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.072 -1.252 . . . . 0.0 110.45 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.8 p -102.12 162.24 13.07 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.384 -0.822 . . . . 0.0 110.249 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.634 ' HA ' HD12 ' B' ' 61' ' ' ILE . 86.8 mt -53.42 -44.72 69.0 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.315 -0.865 . . . . 0.0 110.667 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 7.9 t -56.65 -34.5 67.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.322 -0.861 . . . . 0.0 110.991 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -59.63 -28.06 66.88 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.228 -0.92 . . . . 0.0 110.403 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.641 ' CG ' HD22 ' B' ' 50' ' ' LEU . 73.9 m-85 -101.18 27.42 6.15 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.382 -0.824 . . . . 0.0 109.958 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 31.0 m120 50.94 31.85 6.72 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.46 -0.775 . . . . 0.0 110.757 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.634 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.6 mt -81.7 113.8 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.307 -0.871 . . . . 0.0 110.049 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -105.72 167.93 9.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.367 -0.833 . . . . 0.0 110.122 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 12.2 pttp -46.46 153.09 0.39 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.496 -0.752 . . . . 0.0 110.918 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.4 OUTLIER 62.48 16.8 8.99 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.595 -0.691 . . . . 0.0 110.511 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.51 146.18 48.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 110.302 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 26.2 m -107.67 109.17 20.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.391 -0.818 . . . . 0.0 109.957 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.507 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.56 162.78 12.65 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.293 -0.88 . . . . 0.0 110.075 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -108.75 131.2 55.17 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.215 -0.928 . . . . 0.0 109.906 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.542 ' HB3' HG22 ' B' ' 7' ' ' THR . 57.6 tp -107.17 128.09 54.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.851 . . . . 0.0 110.385 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.433 HG13 HD11 ' B' ' 8' ' ' LEU . 47.2 t -124.93 156.39 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.428 -0.795 . . . . 0.0 110.007 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -94.0 110.62 22.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -92.7 95.97 9.89 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.847 . . . . 0.0 110.186 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -86.2 131.62 34.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.421 -0.8 . . . . 0.0 110.253 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -128.3 83.56 2.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.348 -0.845 . . . . 0.0 110.202 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -140.92 -104.71 0.56 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.347 0 CA-C-O 118.008 -1.44 . . . . 0.0 109.525 -179.984 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 121.199 0.523 . . . . 0.0 110.226 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.35 -167.15 1.6 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.421 -0.799 . . . . 0.0 110.167 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 tp -110.99 24.59 12.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.452 -0.78 . . . . 0.0 109.515 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.97 -60.26 1.2 Allowed Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -136.14 103.94 5.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.45 -1.029 . . . . 0.0 110.204 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -116.48 -144.41 7.99 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -126.16 39.78 3.87 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.362 -1.081 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.59 -28.2 8.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.282 -0.886 . . . . 0.0 110.229 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.55 -27.77 67.92 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.393 -0.817 . . . . 0.0 110.249 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.418 ' O ' ' CD2' ' A' ' 10' ' ' PHE . 38.2 p90 -163.25 121.61 2.0 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.422 -0.799 . . . . 0.0 110.08 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -157.34 37.7 0.29 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.359 -0.838 . . . . 0.0 110.097 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -167.28 -44.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.382 -0.824 . . . . 0.0 110.201 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.59 54.92 0.94 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.5 t -137.84 -63.72 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.362 -1.081 . . . . 0.0 110.057 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.38 161.7 28.58 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.16 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.03 -20.93 28.3 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.805 1.424 . . . . 0.0 110.618 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.5 m -62.69 -17.39 60.56 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.71 -25.81 65.11 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.263 -0.898 . . . . 0.0 110.336 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -168.1 116.49 0.63 Allowed Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.324 -0.86 . . . . 0.0 110.08 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -70.94 -14.2 32.19 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 123.977 1.514 . . . . 0.0 110.016 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.403 ' HB3' ' CG1' ' B' ' 70' ' ' VAL . 7.1 mt-10 -74.23 -30.81 62.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.473 -0.767 . . . . 0.0 109.359 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.09 -30.01 22.91 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.41 -36.33 73.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.551 -0.718 . . . . 0.0 109.352 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.541 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -78.12 -32.2 50.31 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.55 -0.719 . . . . 0.0 109.634 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.5 -32.16 70.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.4 -0.812 . . . . 0.0 109.925 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 62.6 tp -82.54 -21.45 35.37 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.4 -0.813 . . . . 0.0 110.309 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.51 -27.31 34.54 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.259 -0.9 . . . . 0.0 109.314 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 24' ' ' LEU . 66.6 t -85.36 -26.31 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.592 -0.693 . . . . 0.0 109.772 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.17 -45.47 26.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.455 -0.778 . . . . 0.0 110.097 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -35.17 71.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.411 -0.806 . . . . 0.0 110.026 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -70.31 -34.63 72.94 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.368 -0.833 . . . . 0.0 110.041 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -73.9 -45.45 50.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.374 -0.829 . . . . 0.0 110.118 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.96 -47.55 84.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.416 -0.802 . . . . 0.0 110.18 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -40.63 97.67 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.444 -0.785 . . . . 0.0 110.179 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -53.5 -41.02 65.86 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.397 -0.814 . . . . 0.0 110.203 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -82.51 -47.1 12.57 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.403 -0.811 . . . . 0.0 109.936 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.477 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 6.1 mm100 -63.64 -20.31 65.58 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.363 -0.835 . . . . 0.0 110.262 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -84.13 -65.87 0.96 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.264 -0.897 . . . . 0.0 109.553 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.46 -26.8 21.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.332 -0.855 . . . . 0.0 109.563 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.33 -30.53 23.63 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.535 -0.728 . . . . 0.0 109.875 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -84.05 -23.61 30.8 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.272 -0.892 . . . . 0.0 109.98 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.448 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 2.8 mpt_? -82.3 -39.16 23.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.483 -0.761 . . . . 0.0 109.988 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.14 -33.21 63.46 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.015 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.77 -35.81 67.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.355 -0.841 . . . . 0.0 109.991 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.98 -30.58 39.76 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.424 -0.797 . . . . 0.0 110.083 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.52 -37.87 71.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.069 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.71 -33.98 58.17 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.394 -0.816 . . . . 0.0 110.092 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.9 m -69.45 -35.42 75.64 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.36 -0.837 . . . . 0.0 110.159 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -77.95 -26.58 48.9 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.41 -0.806 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -102.38 20.31 17.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.285 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -143.06 -45.67 0.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 110.065 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.19 16.45 26.1 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.38 -0.825 . . . . 0.0 110.357 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.41 -74.15 0.1 Allowed Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.485 ' O ' HD12 ' A' ' 54' ' ' ILE . 1.1 pp -86.46 66.61 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.303 -1.116 . . . . 0.0 110.14 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -132.58 139.9 48.01 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.83 . . . . 0.0 110.236 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.8 p -141.63 93.97 2.63 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.423 -0.798 . . . . 0.0 110.233 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.6 t -74.23 -158.13 0.06 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.386 -0.821 . . . . 0.0 110.1 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -159.45 98.08 0.17 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.709 -1.357 . . . . 0.0 109.709 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.9 p -81.85 62.71 5.77 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -1.037 . . . . 0.0 110.061 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.416 ' O ' ' N ' ' A' ' 62' ' ' SER . 5.4 pt-20 -142.74 45.68 1.59 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.389 -0.82 . . . . 0.0 110.533 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.631 ' O ' ' N ' ' A' ' 63' ' ' ASP . 3.4 t70 -55.92 97.04 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.498 ' HB2' ' HB2' ' A' ' 65' ' ' ALA . 79.3 p -51.11 78.3 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 CA-C-O 121.666 0.746 . . . . 0.0 110.724 -177.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' A' ' 61' ' ' ASP . 9.2 t0 -61.51 -31.28 71.27 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.736 -0.602 . . . . 0.0 110.165 179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -76.11 -29.77 58.0 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.296 -0.877 . . . . 0.0 109.131 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' ' HB2' ' A' ' 62' ' ' SER . . . -61.81 -44.47 96.8 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.492 -0.883 . . . . 0.0 108.796 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -29.2 70.26 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.87 -40.21 55.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.466 -0.771 . . . . 0.0 109.87 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HA ' HG22 ' A' ' 71' ' ' ILE . 10.8 mmtp -81.79 -55.28 4.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.387 -0.821 . . . . 0.0 110.516 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 tpp -52.37 -42.42 63.95 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.152 -0.968 . . . . 0.0 110.604 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 84.7 m -68.02 -42.86 80.01 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.311 -0.868 . . . . 0.0 110.559 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.415 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.3 tp -82.5 -12.99 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.231 -0.918 . . . . 0.0 110.413 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.9 m -76.08 -39.43 55.37 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.338 -0.851 . . . . 0.0 109.749 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -84.35 -27.09 27.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.416 -0.802 . . . . 0.0 110.079 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.18 -44.54 14.92 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.402 -0.811 . . . . 0.0 110.359 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -69.52 -38.58 77.62 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 110.202 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -105.62 87.36 2.58 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.298 -0.877 . . . . 0.0 110.186 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -153.42 -73.4 0.01 OUTLIER Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.377 -1.489 . . . . 0.0 109.377 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 -71.92 -32.5 67.41 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.367 -1.078 . . . . 0.0 110.067 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.678 HG22 ' O ' ' A' ' 79' ' ' THR . 92.6 m 51.4 27.17 3.53 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.314 -0.866 . . . . 0.0 109.953 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.442 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 87.77 -87.18 1.52 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 108.905 -1.678 . . . . 0.0 108.905 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.846 HD23 ' HD2' ' A' ' 82' ' ' PRO . 0.2 OUTLIER 176.99 153.69 0.41 Allowed Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.73 -0.865 . . . . 0.0 108.971 179.652 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.846 ' HD2' HD23 ' A' ' 81' ' ' LEU . 47.7 Cg_endo -75.6 48.84 2.25 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 123.59 1.31 . . . . 0.0 110.596 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.59 110.67 21.11 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.252 -0.905 . . . . 0.0 110.128 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.2 mp -57.88 -26.67 62.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.845 . . . . 0.0 110.217 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -14.51 62.96 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.338 -0.851 . . . . 0.0 110.327 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.8 t -109.76 -4.31 16.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.283 -0.886 . . . . 0.0 110.412 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 11.3 mtt -96.39 -163.66 1.07 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.202 -0.936 . . . . 0.0 110.129 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.6 p -141.5 -167.81 2.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.406 -0.808 . . . . 0.0 110.185 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.575 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.3 pt-20 -71.52 -32.36 68.1 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.457 -0.777 . . . . 0.0 109.207 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 26.7 mt-10 -85.24 -38.18 19.21 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.967 -0.693 . . . . 0.0 109.272 179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -43.21 89.19 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 178.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -68.07 -35.23 77.86 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.575 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.81 -37.74 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.46 -33.35 74.66 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.496 -0.752 . . . . 0.0 109.823 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -75.78 -31.66 59.58 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.36 -32.44 29.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.457 -0.777 . . . . 0.0 110.167 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.54 -29.77 27.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.36 -0.837 . . . . 0.0 109.689 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -75.35 -31.08 60.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.373 -0.829 . . . . 0.0 109.915 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 2.2 tpt -78.51 -37.84 42.13 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.385 -0.822 . . . . 0.0 110.026 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 t -66.67 -28.32 68.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.389 -0.819 . . . . 0.0 110.083 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.418 ' HA ' HD13 ' A' ' 101' ' ' LEU . 4.1 mm? -99.94 -31.53 11.43 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.467 -0.771 . . . . 0.0 110.143 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -123.16 59.93 1.07 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.378 -0.826 . . . . 0.0 110.17 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -102.24 -63.92 0.74 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.37 75.44 1.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.376 -1.073 . . . . 0.0 110.22 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -79.94 -63.46 1.41 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.36 -0.838 . . . . 0.0 110.202 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.31 -40.4 2.26 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.339 -0.85 . . . . 0.0 110.187 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.43 -35.15 1.57 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -92.33 84.3 5.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.342 -1.093 . . . . 0.0 110.197 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -159.25 -71.05 0.08 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.386 -0.821 . . . . 0.0 110.228 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -104.42 29.95 5.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.147 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.4 p -124.02 155.28 38.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.387 -0.821 . . . . 0.0 110.211 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 117.965 -1.016 . . . . 0.0 110.164 179.964 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.435 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.4 ttp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.253 0.549 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 140.68 29.48 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.33 -0.856 . . . . 0.0 109.725 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.41 158.06 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.235 -0.915 . . . . 0.0 110.32 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.81 143.85 42.08 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.71 -0.619 . . . . 0.0 110.681 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 64.1 t -127.99 124.58 63.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.377 -0.827 . . . . 0.0 109.517 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 13.1 mttt -99.88 134.11 43.27 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.423 -0.798 . . . . 0.0 110.291 -179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 40.3 p -95.47 172.89 7.8 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.331 -0.856 . . . . 0.0 110.302 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.475 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.26 -13.54 19.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.486 -0.759 . . . . 0.0 111.034 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.5 p -95.72 -5.77 41.36 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.026 -1.046 . . . . 0.0 110.997 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.99 9.43 57.21 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.1 OUTLIER -84.62 136.53 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.06 -1.259 . . . . 0.0 109.779 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 31.0 m -113.07 127.32 56.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.229 -0.919 . . . . 0.0 110.373 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.29 137.27 42.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.446 -0.784 . . . . 0.0 110.328 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 23.3 m -102.09 120.68 40.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.3 mt -123.48 158.59 30.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.095 -1.003 . . . . 0.0 110.918 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -106.29 113.8 27.54 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 109.385 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.62 HG12 ' HD3' ' B' ' 29' ' ' LYS . 34.0 m -140.29 177.4 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.266 -0.896 . . . . 0.0 110.938 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.52 ' O ' HD12 ' B' ' 56' ' ' LEU . 18.3 mt-10 -113.03 164.61 15.07 Favored Pre-proline 0 N--CA 1.489 1.485 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.89 -27.27 17.87 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.523 1.275 . . . . 0.0 110.282 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.63 -1.34 55.9 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.885 . . . . 0.0 110.735 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -70.99 143.87 50.67 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.073 -1.017 . . . . 0.0 110.296 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 81.1 p -83.4 159.15 21.87 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.491 -0.756 . . . . 0.0 110.606 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.48 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 44.7 mm -59.62 -37.45 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.381 -0.824 . . . . 0.0 109.461 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -60.22 -34.67 73.98 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.422 -0.799 . . . . 0.0 109.358 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.47 -33.77 71.65 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.543 -0.723 . . . . 0.0 109.264 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.1 t -70.04 -40.06 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.454 -0.779 . . . . 0.0 109.26 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -62.9 -42.62 99.85 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.462 -0.774 . . . . 0.0 109.206 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.56 74.01 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.481 -0.762 . . . . 0.0 109.368 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.62 ' HD3' HG12 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -68.15 -39.8 82.56 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.567 -0.708 . . . . 0.0 109.535 179.408 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.553 HD13 HD22 ' B' ' 69' ' ' LEU . 17.8 mt -67.01 -37.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.96 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 50.0 tt0 -60.77 -50.57 72.93 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.377 -0.827 . . . . 0.0 109.374 178.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -58.07 -27.72 63.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 110.517 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mmtt -83.93 -39.04 20.29 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.307 -0.871 . . . . 0.0 110.778 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -108.07 -56.85 2.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.358 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 127.23 19.19 1.96 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 110.079 -1.209 . . . . 0.0 110.079 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.518 HG23 ' HD2' ' B' ' 37' ' ' PRO . 25.2 mt -91.43 144.03 29.06 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.092 -1.24 . . . . 0.0 109.93 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.518 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.6 Cg_endo -68.28 132.3 25.5 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.714 1.376 . . . . 0.0 110.459 179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.67 -25.12 80.28 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.736 1.387 . . . . 0.0 110.816 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.9 -26.15 64.95 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.418 -0.801 . . . . 0.0 109.84 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.439 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.6 mm100 -101.24 2.5 39.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.446 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -94.21 139.65 30.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.09 129.05 43.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.38 -0.825 . . . . 0.0 110.15 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.907 ' HB3' HD12 ' B' ' 50' ' ' LEU . 17.4 mt -104.71 118.57 36.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.797 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.09 135.09 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.436 -0.79 . . . . 0.0 109.992 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -140.73 149.5 42.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.606 -0.684 . . . . 0.0 109.543 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 28.46 0.52 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.423 -0.798 . . . . 0.0 111.088 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.36 2.1 78.14 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -111.04 136.79 49.52 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.093 -1.239 . . . . 0.0 110.215 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -78.4 138.99 38.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.227 -0.921 . . . . 0.0 109.824 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.907 HD12 ' HB3' ' B' ' 43' ' ' LEU . 47.9 mt -83.68 140.8 31.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.374 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -93.56 128.15 39.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.409 -0.807 . . . . 0.0 110.429 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 75.4 m-20 -48.35 -29.88 4.39 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.472 -0.767 . . . . 0.0 111.127 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.92 -5.19 89.58 Favored Glycine 0 N--CA 1.493 2.498 0 C-N-CA 120.121 -1.038 . . . . 0.0 110.622 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmt-85 -99.34 155.97 17.24 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.983 -1.304 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.7 p -102.46 165.4 11.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.393 -0.817 . . . . 0.0 110.232 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.52 HD12 ' O ' ' B' ' 18' ' ' GLU . 64.9 mt -53.78 -47.62 70.57 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.779 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 29.1 t -56.75 -35.95 69.22 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.333 -0.854 . . . . 0.0 111.18 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -59.47 -27.38 66.06 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.107 -0.995 . . . . 0.0 110.236 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.473 ' CD2' HD22 ' B' ' 50' ' ' LEU . 34.2 m-85 -101.37 27.96 5.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.394 -0.816 . . . . 0.0 109.919 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 50.72 26.51 2.56 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.513 -0.742 . . . . 0.0 110.829 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.52 HD13 HD21 ' B' ' 67' ' ' LEU . 96.4 mt -81.53 109.56 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.274 -0.891 . . . . 0.0 109.906 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -105.68 173.38 6.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.379 -179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.7 151.72 0.56 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 111.088 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 35.0 mt-10 63.0 16.33 9.17 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.768 -0.582 . . . . 0.0 110.616 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.4 144.61 49.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 12.6 m -107.4 108.46 19.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 109.821 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.52 HD21 HD13 ' B' ' 61' ' ' ILE . 1.9 mt -102.31 160.29 14.66 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.318 -0.864 . . . . 0.0 110.041 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -108.95 132.89 53.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.278 -0.889 . . . . 0.0 110.151 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.553 HD22 HD13 ' B' ' 30' ' ' ILE . 61.8 tp -107.21 130.94 54.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.861 . . . . 0.0 109.95 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.403 ' CG1' ' HB3' ' A' ' 21' ' ' GLU . 16.6 t -124.81 149.58 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.452 -0.78 . . . . 0.0 110.155 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.0 mt -94.46 136.66 34.51 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.471 -0.768 . . . . 0.0 110.155 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.33 103.45 10.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.154 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.57 111.93 24.81 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.271 -0.893 . . . . 0.0 110.248 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.52 93.77 3.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.343 -0.848 . . . . 0.0 110.184 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -148.16 -134.23 2.42 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 CA-C-O 118.05 -1.417 . . . . 0.0 109.56 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.5 m170 . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.22 0.534 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.2 mtp -68.54 -178.06 1.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.356 -0.84 . . . . 0.0 110.265 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 12.2 mt -112.05 24.71 12.32 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.502 -0.748 . . . . 0.0 109.599 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.49 -129.35 2.53 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 5' ' ' LEU . 5.5 mp -116.12 65.35 0.7 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.409 -1.054 . . . . 0.0 110.19 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -99.15 35.25 4.8 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.25 27.51 4.79 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.356 -1.085 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 t -129.72 24.25 5.39 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.368 -0.832 . . . . 0.0 110.337 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -79.69 -24.56 41.66 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.214 -0.929 . . . . 0.0 110.115 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -111.09 72.64 0.79 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.323 -0.861 . . . . 0.0 110.2 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.8 tp10 -106.69 82.09 1.67 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.343 -0.848 . . . . 0.0 110.313 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 51.95 26.93 3.97 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.396 -0.815 . . . . 0.0 110.605 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -134.74 32.02 2.66 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.551 -1.419 . . . . 0.0 109.551 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.487 HG13 ' N ' ' A' ' 15' ' ' ASP . 10.1 p -136.27 -39.31 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.305 -1.115 . . . . 0.0 110.353 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.487 ' N ' HG13 ' A' ' 14' ' ' VAL . 23.3 t0 -113.53 123.31 33.4 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.308 -0.87 . . . . 0.0 110.014 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.84 -24.03 25.21 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 O-C-N 123.537 1.283 . . . . 0.0 110.681 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.2 t -61.32 -19.15 61.47 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.265 -0.897 . . . . 0.0 110.269 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.68 -27.39 63.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.207 -0.933 . . . . 0.0 110.152 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -159.64 113.69 1.5 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 110.059 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -72.01 -10.27 25.84 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.994 1.523 . . . . 0.0 110.432 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HB3' HG13 ' B' ' 70' ' ' VAL . 34.3 mt-10 -79.64 -31.94 41.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.299 -0.876 . . . . 0.0 109.125 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.514 ' C ' HD23 ' A' ' 22' ' ' LEU . 4.8 tt -84.57 -29.32 25.95 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.63 -35.11 74.95 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.686 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.0 OUTLIER -77.44 -29.87 53.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.554 -0.716 . . . . 0.0 109.304 179.218 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.81 -29.67 68.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.463 -0.773 . . . . 0.0 109.777 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.01 -24.73 32.73 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.404 -0.81 . . . . 0.0 110.14 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -85.0 -30.58 24.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 109.639 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 24' ' ' LEU . 75.5 t -79.39 -30.97 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 121.469 -0.769 . . . . 0.0 109.809 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 55.1 m -76.53 -48.66 18.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.988 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.04 -43.03 99.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.354 -0.841 . . . . 0.0 110.02 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.84 -32.55 74.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.44 -0.788 . . . . 0.0 109.875 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.52 -47.21 86.63 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.43 -0.794 . . . . 0.0 110.024 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -61.43 -37.55 83.92 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.23 -34.94 77.16 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.434 -0.791 . . . . 0.0 110.096 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.89 -39.05 90.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.406 -0.809 . . . . 0.0 109.902 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -77.44 -44.1 30.2 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.371 -0.83 . . . . 0.0 110.157 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.583 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -64.13 -27.78 69.32 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.493 -0.755 . . . . 0.0 110.229 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -83.69 -56.38 3.75 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.417 -0.802 . . . . 0.0 109.472 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -53.23 -30.93 40.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.81 . . . . 0.0 109.177 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -86.02 -36.79 19.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.773 -0.579 . . . . 0.0 109.457 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.583 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -66.67 -53.51 33.05 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.929 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 32.6 mtt85 -64.23 -33.85 76.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.468 -0.77 . . . . 0.0 110.087 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.83 -37.46 73.87 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.052 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.18 -27.14 42.62 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.315 -0.865 . . . . 0.0 109.874 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.82 -28.24 58.22 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.421 -0.8 . . . . 0.0 110.122 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.04 -47.9 14.16 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.113 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.08 72.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.865 . . . . 0.0 110.173 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.8 m -83.48 -41.97 17.42 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.38 -0.825 . . . . 0.0 110.194 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.64 -29.47 65.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.146 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -27.26 68.45 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.384 -0.823 . . . . 0.0 110.207 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -79.82 89.21 5.23 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.341 -0.85 . . . . 0.0 110.157 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.81 30.1 8.55 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 110.411 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -110.12 -61.18 0.5 Allowed Glycine 0 N--CA 1.493 2.439 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.9 tt -110.97 -18.98 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.286 -1.126 . . . . 0.0 110.363 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.64 -177.62 5.47 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.164 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.5 t -114.17 153.71 29.1 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.318 -0.864 . . . . 0.0 110.256 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 17.5 p -118.52 77.69 1.19 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.308 -0.87 . . . . 0.0 110.263 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.56 56.78 0.2 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 11.1 m -95.22 71.33 3.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.352 -1.087 . . . . 0.0 110.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -74.1 79.22 1.74 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.8 -25.99 12.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.396 -0.815 . . . . 0.0 110.238 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.463 ' HB2' ' HB2' ' A' ' 65' ' ' ALA . 60.2 p -112.37 68.71 0.68 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.343 -0.848 . . . . 0.0 110.168 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.5 -33.19 74.39 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.416 -0.803 . . . . 0.0 110.192 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -76.23 -28.24 57.1 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.205 -0.934 . . . . 0.0 109.221 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.463 ' HB2' ' HB2' ' A' ' 62' ' ' SER . . . -62.37 -42.7 99.62 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.584 -0.846 . . . . 0.0 108.882 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -66.85 -29.66 69.63 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -76.58 -37.53 56.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.578 -0.701 . . . . 0.0 109.871 179.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.457 ' HA ' HG22 ' A' ' 71' ' ' ILE . 21.5 mmtm -83.87 -55.24 4.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 110.361 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.9 tpt -52.86 -42.75 65.52 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 89.7 m -69.96 -41.85 73.95 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.457 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.8 tp -83.77 -12.08 11.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 110.59 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 68' ' ' LYS . 83.5 p -78.78 -45.42 21.06 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.175 -0.953 . . . . 0.0 109.801 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -82.97 -18.78 38.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.499 -0.751 . . . . 0.0 110.267 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -92.76 -34.4 13.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.184 -0.947 . . . . 0.0 110.677 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.426 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.7 tt0 -80.6 -30.4 36.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.23 -0.919 . . . . 0.0 110.448 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.37 105.34 0.11 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.337 -0.852 . . . . 0.0 110.444 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 170.23 -48.24 0.2 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.77 32.53 4.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.463 -1.022 . . . . 0.0 110.129 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.573 HG23 ' O ' ' A' ' 79' ' ' THR . 10.7 t -79.87 59.75 3.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.398 -0.813 . . . . 0.0 110.086 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.522 ' C ' HD12 ' A' ' 81' ' ' LEU . . . -79.54 4.43 64.26 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 81' ' ' LEU . 4.6 mp -143.06 130.57 10.95 Favored Pre-proline 0 C--N 1.308 -1.234 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -71.74 42.1 0.48 Allowed 'Trans proline' 0 C--N 1.303 -1.86 0 O-C-N 123.355 1.187 . . . . 0.0 110.728 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.9 t70 49.1 91.6 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.798 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.7 mt -69.0 -27.74 65.97 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -66.56 -21.93 66.15 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.284 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 39.5 t -85.24 -24.66 27.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.292 -0.88 . . . . 0.0 110.19 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 40.1 mtt -59.96 116.6 4.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.496 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.6 p -73.75 -160.74 0.09 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.496 -0.752 . . . . 0.0 110.433 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 pt-20 -70.78 -30.04 66.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.514 -0.741 . . . . 0.0 109.149 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.453 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 6.9 mt-10 -83.44 -38.37 21.97 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.496 ' HB2' ' N ' ' A' ' 88' ' ' THR . 69.5 mm-40 -65.37 -43.69 89.98 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -66.95 -35.27 79.6 Favored 'General case' 0 N--CA 1.487 1.38 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -64.99 -36.95 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.77 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.96 81.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.429 -0.794 . . . . 0.0 109.79 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.18 -54.52 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.393 -0.817 . . . . 0.0 110.072 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.3 -34.15 74.75 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.724 ' HG2' HD23 ' A' ' 101' ' ' LEU . 53.5 ttp -80.91 -25.28 37.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.799 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -41.29 97.46 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.427 -0.796 . . . . 0.0 109.997 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 41.5 mmm -82.17 -24.73 34.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.378 -0.826 . . . . 0.0 110.231 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.24 -34.62 42.55 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.38 -0.825 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.724 HD23 ' HG2' ' A' ' 97' ' ' MET . 0.5 OUTLIER -59.5 -22.82 62.16 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.35 -0.844 . . . . 0.0 110.284 -179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -85.62 -27.7 25.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.293 -0.879 . . . . 0.0 110.194 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 72.27 99.78 0.07 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -160.21 102.13 1.41 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -1.097 . . . . 0.0 110.224 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -87.08 -37.1 17.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.377 -0.827 . . . . 0.0 110.274 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.04 -58.58 0.27 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.385 -0.822 . . . . 0.0 110.267 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.31 -112.6 2.52 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -164.55 113.33 1.12 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.407 -1.055 . . . . 0.0 110.354 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.0 88.82 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.33 -0.856 . . . . 0.0 110.587 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -127.94 42.1 3.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.436 -0.79 . . . . 0.0 110.111 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 28.7 t -169.3 -51.1 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.332 -0.855 . . . . 0.0 110.192 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.265 179.995 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.442 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.3 ttp . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.21 0.528 . . . . 0.0 110.473 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -92.69 140.55 29.41 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.405 -0.81 . . . . 0.0 109.708 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.654 HD13 HG21 ' B' ' 17' ' ' VAL . 42.6 pt -137.33 158.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.19 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -111.67 145.88 38.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.557 -0.714 . . . . 0.0 110.427 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' B' ' 12' ' ' THR . 61.7 t -127.89 122.55 58.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.452 -0.78 . . . . 0.0 109.95 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.473 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -100.38 128.51 46.43 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.515 -0.741 . . . . 0.0 110.257 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.505 HG22 HD23 ' B' ' 69' ' ' LEU . 66.8 p -95.74 177.51 5.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.371 -0.83 . . . . 0.0 110.473 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.471 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.12 -16.98 50.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.44 -0.788 . . . . 0.0 110.841 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.6 p -96.04 21.71 8.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.065 -1.022 . . . . 0.0 110.661 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.6 15.96 58.13 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.9 ttpm? -84.73 131.58 34.55 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.128 -1.219 . . . . 0.0 109.821 179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.417 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 22.5 m -112.84 125.21 54.11 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.402 HD13 HG21 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -109.65 141.52 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.399 -0.813 . . . . 0.0 110.258 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.613 ' C ' HD12 ' B' ' 15' ' ' LEU . 7.4 m -101.94 120.06 39.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.427 -0.796 . . . . 0.0 109.295 179.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.613 HD12 ' C ' ' B' ' 14' ' ' THR . 7.2 mp -123.24 159.64 28.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.211 -0.931 . . . . 0.0 110.978 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.62 114.96 29.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 109.317 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.654 HG21 HD13 ' B' ' 3' ' ' ILE . 32.7 m -140.15 172.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.241 -0.912 . . . . 0.0 110.883 -179.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.576 ' O ' HD12 ' B' ' 56' ' ' LEU . 3.4 mp0 -112.86 165.1 13.82 Favored Pre-proline 0 N--CA 1.489 1.478 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.54 -28.29 17.79 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.587 1.309 . . . . 0.0 110.384 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -84.66 -2.14 57.09 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.199 -0.938 . . . . 0.0 110.649 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -71.14 141.67 50.75 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.22 -0.925 . . . . 0.0 110.538 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.0 p -83.36 159.77 21.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.717 . . . . 0.0 110.378 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.4 mm -59.93 -35.46 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.377 -0.827 . . . . 0.0 109.773 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -60.83 -38.04 84.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.376 -0.828 . . . . 0.0 109.587 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -69.95 -31.51 69.29 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 109.195 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 22' ' ' THR . 67.2 t -70.1 -39.8 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.45 -0.781 . . . . 0.0 109.086 179.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.05 -42.16 99.66 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.565 -0.709 . . . . 0.0 109.144 179.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.27 -34.74 75.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.5 -0.75 . . . . 0.0 109.243 179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.523 ' HD3' HG12 ' B' ' 17' ' ' VAL . 17.6 mttp -68.13 -35.48 78.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.328 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.2 mt -67.71 -42.04 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.447 -0.783 . . . . 0.0 109.279 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' B' ' 35' ' ' GLY . 11.4 tt0 -60.11 -49.58 77.09 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.413 -0.805 . . . . 0.0 109.445 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -58.35 -25.81 62.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.379 -0.826 . . . . 0.0 110.393 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm -84.04 -43.97 14.59 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.262 -0.898 . . . . 0.0 110.873 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -107.99 -50.29 3.07 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.219 -0.926 . . . . 0.0 110.631 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.55 18.23 3.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 110.074 -1.211 . . . . 0.0 110.074 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.545 HG23 ' HD2' ' B' ' 37' ' ' PRO . 91.0 mt -91.28 145.32 31.26 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.133 -1.216 . . . . 0.0 109.735 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.545 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.2 Cg_endo -67.75 133.93 31.02 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.579 1.304 . . . . 0.0 110.505 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.71 -25.94 81.97 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.781 1.411 . . . . 0.0 110.746 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.7 -21.98 64.38 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.785 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.424 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.2 mt-30 -101.18 0.59 37.86 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.463 -0.773 . . . . 0.0 110.337 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -94.25 138.51 32.18 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.892 . . . . 0.0 110.472 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.501 ' C ' HD22 ' B' ' 43' ' ' LEU . 1.2 mtt85 -130.06 128.53 42.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.815 . . . . 0.0 109.715 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.776 ' C ' HD12 ' B' ' 44' ' ' ILE . 4.5 mm? -104.44 114.94 29.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.367 -0.833 . . . . 0.0 110.37 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.776 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.23 134.07 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.561 -0.712 . . . . 0.0 109.811 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -140.92 148.6 40.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.421 -0.799 . . . . 0.0 109.95 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.49 28.57 0.51 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.506 -0.746 . . . . 0.0 111.134 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.58 2.16 84.38 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.03 130.99 55.42 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.117 -1.225 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -78.52 136.68 37.62 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.318 -0.864 . . . . 0.0 109.814 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.753 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.4 mt -83.99 141.09 31.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.302 -0.874 . . . . 0.0 110.303 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -93.79 133.12 37.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.357 -0.84 . . . . 0.0 110.396 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.515 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 15.8 m-20 -48.17 -30.62 4.79 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.514 -0.741 . . . . 0.0 111.195 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -5.51 89.21 Favored Glycine 0 N--CA 1.494 2.548 0 C-N-CA 120.159 -1.019 . . . . 0.0 110.732 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.446 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 9.1 mmt-85 -99.28 155.12 17.67 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.053 -1.263 . . . . 0.0 110.477 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.5 p -102.16 163.97 11.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.46 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.576 HD12 ' O ' ' B' ' 18' ' ' GLU . 83.5 mt -53.69 -45.44 70.37 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.352 -0.843 . . . . 0.0 110.877 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 18.2 t -56.58 -34.2 66.93 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.408 -0.807 . . . . 0.0 110.956 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -59.7 -27.79 66.75 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.753 ' CD2' HD22 ' B' ' 50' ' ' LEU . 76.7 m-85 -101.19 26.0 7.58 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.35 -0.844 . . . . 0.0 110.166 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 50.68 30.4 4.9 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.436 -0.79 . . . . 0.0 110.848 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.502 HD13 HD21 ' B' ' 67' ' ' LEU . 94.7 mt -81.41 113.64 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.215 -0.928 . . . . 0.0 109.84 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -105.68 170.44 7.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.303 -0.873 . . . . 0.0 110.366 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.1 pttt -46.71 152.46 0.48 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.5 -0.75 . . . . 0.0 111.11 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.4 mm-40 63.31 15.03 8.34 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.688 -0.632 . . . . 0.0 110.696 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.74 144.47 49.24 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.147 -0.97 . . . . 0.0 110.073 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -107.44 113.18 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.81 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.502 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.39 162.45 12.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.4 -0.813 . . . . 0.0 110.125 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -108.74 132.59 53.81 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.333 -0.854 . . . . 0.0 109.665 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.505 HD23 HG22 ' B' ' 7' ' ' THR . 42.7 tp -106.89 131.25 54.19 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 110.314 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.402 HG13 ' HB3' ' A' ' 21' ' ' GLU . 45.6 t -124.96 155.88 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.417 -0.802 . . . . 0.0 110.289 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt -94.14 136.32 34.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.252 -0.905 . . . . 0.0 110.132 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 32.7 ttt-85 -98.21 82.93 3.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.25 -0.907 . . . . 0.0 110.194 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.53 -170.44 1.86 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.393 -0.817 . . . . 0.0 110.125 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.08 41.76 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.419 -0.801 . . . . 0.0 110.144 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 161.52 121.54 0.58 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 CA-C-O 117.936 -1.48 . . . . 0.0 109.548 -179.997 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.2 p80 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.224 0.535 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mtp -143.49 178.8 7.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.242 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.6 25.0 12.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.436 -0.79 . . . . 0.0 109.527 179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.24 51.01 3.38 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 mp -76.82 68.82 3.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.371 -1.076 . . . . 0.0 110.196 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -120.54 36.8 3.25 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -81.53 -31.54 32.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.4 -1.059 . . . . 0.0 110.059 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.7 p -77.75 -14.27 59.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.453 -0.779 . . . . 0.0 110.449 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -56.81 -32.52 65.79 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.224 -0.922 . . . . 0.0 110.318 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -112.25 93.31 4.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.365 -0.835 . . . . 0.0 110.158 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -80.55 61.63 4.34 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.408 -0.808 . . . . 0.0 110.129 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -146.21 70.19 1.22 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.803 . . . . 0.0 110.22 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.615 ' H ' ' HB2' ' A' ' 18' ' ' ALA . . . 125.9 -63.1 0.59 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.422 HG13 ' N ' ' A' ' 15' ' ' ASP . 11.6 p -61.51 -34.92 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.476 -1.014 . . . . 0.0 110.256 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.422 ' N ' HG13 ' A' ' 14' ' ' VAL . 0.5 OUTLIER -78.99 163.25 61.21 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.367 -0.833 . . . . 0.0 110.316 -179.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.482 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 46.6 Cg_endo -71.47 -20.24 27.56 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.854 1.45 . . . . 0.0 110.751 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 t -67.32 -13.61 62.16 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.299 -0.876 . . . . 0.0 110.579 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.615 ' HB2' ' H ' ' A' ' 13' ' ' GLY . . . -86.87 -23.69 25.17 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.185 -0.947 . . . . 0.0 110.504 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -169.47 118.65 0.57 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.191 -0.943 . . . . 0.0 110.156 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.95 -14.61 35.71 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 O-C-N 123.785 1.413 . . . . 0.0 110.184 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -74.15 -31.13 62.59 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.795 . . . . 0.0 109.315 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mp -87.87 -31.15 19.65 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.482 ' HB2' ' CB ' ' A' ' 16' ' ' PRO . . . -71.74 -31.11 66.33 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.291 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.596 HD23 HD22 ' B' ' 8' ' ' LEU . 21.5 tp -80.77 -34.7 34.02 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.58 -0.7 . . . . 0.0 109.457 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.3 -33.3 75.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.429 -0.794 . . . . 0.0 109.84 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.09 -22.02 33.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.428 -0.795 . . . . 0.0 110.266 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.0 mtp180 -82.34 -32.05 29.55 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.254 -0.904 . . . . 0.0 109.12 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 24' ' ' LEU . 59.2 t -81.38 -28.33 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.641 -0.662 . . . . 0.0 109.662 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.2 -43.64 56.43 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.452 -0.78 . . . . 0.0 109.96 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.5 -44.03 83.68 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.417 -0.802 . . . . 0.0 109.818 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -42.71 99.21 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.444 -0.785 . . . . 0.0 109.951 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -66.05 -44.59 84.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.356 -0.84 . . . . 0.0 109.987 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -66.13 -43.63 86.56 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.475 -0.765 . . . . 0.0 110.034 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.99 -43.68 91.76 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.36 -0.837 . . . . 0.0 110.12 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -59.33 -40.26 85.73 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.377 -0.827 . . . . 0.0 110.102 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -37.67 69.07 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.402 -0.811 . . . . 0.0 109.992 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.678 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.2 tp60 -75.16 -26.01 58.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.383 -0.823 . . . . 0.0 109.981 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -83.77 -57.5 3.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.421 -0.8 . . . . 0.0 109.677 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -52.37 -31.71 35.11 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.465 -0.772 . . . . 0.0 109.216 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.1 -34.21 22.25 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.678 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.72 -51.65 64.03 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.485 -0.759 . . . . 0.0 109.675 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.5 ptt180 -66.75 -30.99 71.35 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.354 -0.841 . . . . 0.0 109.754 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.8 tpm_? -54.27 -41.14 68.49 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.37 -0.831 . . . . 0.0 109.182 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.98 -26.05 56.39 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.98 -27.45 64.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.587 -0.696 . . . . 0.0 109.674 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.56 -43.54 14.4 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.483 -0.76 . . . . 0.0 110.038 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.17 -30.48 70.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.413 -0.804 . . . . 0.0 110.144 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.03 -42.5 12.38 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.378 -0.826 . . . . 0.0 110.166 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.45 -32.89 74.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.39 -0.819 . . . . 0.0 110.14 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.88 -27.7 68.98 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.452 -0.78 . . . . 0.0 110.05 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 55' ' ' ALA . 8.4 mm-40 -111.41 27.02 10.07 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -0.847 . . . . 0.0 110.201 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -148.09 -52.62 0.19 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.309 -0.869 . . . . 0.0 110.084 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.66 -49.42 18.58 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.61 ' N ' HD12 ' A' ' 54' ' ' ILE . 5.4 mp -110.01 -24.55 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.488 -1.007 . . . . 0.0 110.137 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 54' ' ' ILE . . . 58.76 167.05 0.05 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.34 -0.85 . . . . 0.0 110.26 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 10.0 p -105.35 177.04 4.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 110.253 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.3 p -98.13 -176.64 3.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.369 -0.832 . . . . 0.0 110.262 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -121.75 50.62 0.83 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.15 63.57 8.18 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.402 -1.058 . . . . 0.0 110.049 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.06 83.49 7.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.368 -0.833 . . . . 0.0 110.267 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.54 -34.23 76.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.316 -0.865 . . . . 0.0 110.061 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.489 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 1.8 m -111.39 73.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.339 -0.851 . . . . 0.0 110.131 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -73.05 -37.59 66.78 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.375 -0.828 . . . . 0.0 110.401 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -78.14 -32.9 50.56 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.169 -0.957 . . . . 0.0 109.471 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.489 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -61.49 -37.06 82.28 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.402 -0.919 . . . . 0.0 108.736 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.456 ' O ' HG23 ' A' ' 70' ' ' THR . 5.9 mt -69.55 -31.44 69.63 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.14 -43.89 55.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.583 -0.698 . . . . 0.0 109.576 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -75.9 -53.42 8.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.497 -0.752 . . . . 0.0 110.094 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.0 ttt -49.36 -37.34 24.47 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.256 -0.903 . . . . 0.0 110.743 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.456 HG23 ' O ' ' A' ' 66' ' ' LEU . 15.5 p -71.09 -39.59 72.05 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.334 -0.854 . . . . 0.0 110.526 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.411 HG22 ' O ' ' A' ' 68' ' ' LYS . 5.1 tp -83.93 -16.82 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.256 -0.903 . . . . 0.0 110.289 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.87 -41.19 60.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.946 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -86.63 -19.24 29.6 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.46 -0.775 . . . . 0.0 110.28 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -92.02 -42.91 9.72 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.28 -0.887 . . . . 0.0 110.338 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -75.43 -33.3 60.9 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.341 -0.849 . . . . 0.0 110.061 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.401 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 21.6 t80 -96.25 21.35 9.07 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.45 -0.781 . . . . 0.0 110.327 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.87 -37.04 57.2 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.306 -1.517 . . . . 0.0 109.306 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.38 114.06 28.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.428 -1.042 . . . . 0.0 110.141 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.7 m -124.32 41.1 3.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.404 -0.81 . . . . 0.0 110.258 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.64 48.25 1.37 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -172.45 147.7 1.77 Allowed Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.332 -1.099 . . . . 0.0 108.881 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.56 63.78 2.96 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 123.593 1.312 . . . . 0.0 110.46 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.404 ' N ' ' OD1' ' A' ' 83' ' ' ASP . 36.1 p-10 -54.36 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.342 -0.849 . . . . 0.0 110.465 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.645 HD23 ' HG2' ' A' ' 92' ' ' GLN . 1.9 mt -94.73 -29.35 14.83 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.285 -0.885 . . . . 0.0 110.181 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.66 -22.08 43.82 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.344 -0.847 . . . . 0.0 110.411 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.4 t -103.49 -19.24 14.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.31 -0.869 . . . . 0.0 110.472 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 26.4 mtp -90.97 129.07 37.02 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.287 -0.883 . . . . 0.0 110.357 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.481 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 81.4 p -72.44 -157.21 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.423 -0.798 . . . . 0.0 110.254 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.556 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.4 mt-10 -75.82 -29.26 58.59 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.447 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 2.6 mp0 -85.48 -36.53 20.5 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.481 ' HB2' ' N ' ' A' ' 88' ' ' THR . 63.1 mm-40 -66.26 -44.35 83.87 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.645 ' HG2' HD23 ' A' ' 84' ' ' LEU . 72.5 mt-30 -66.66 -33.7 76.23 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.556 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -70.64 -33.69 54.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.737 -0.602 . . . . 0.0 109.401 178.92 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.19 91.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.432 -0.793 . . . . 0.0 110.051 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.82 -37.22 21.0 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 109.967 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.17 -37.88 81.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.271 -0.893 . . . . 0.0 110.185 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.2 ttt -81.51 -22.56 37.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.948 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.82 -44.29 73.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.364 -0.835 . . . . 0.0 110.094 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -79.14 -24.73 43.12 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.379 -0.825 . . . . 0.0 110.316 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.122 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.1 mt -97.23 14.67 25.17 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.342 -0.849 . . . . 0.0 110.442 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -139.77 41.73 1.99 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.221 -0.924 . . . . 0.0 110.268 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 170.71 40.08 0.03 OUTLIER Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -170.01 100.11 0.29 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.405 -1.056 . . . . 0.0 110.123 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -46.01 91.27 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.408 -0.807 . . . . 0.0 110.177 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -157.78 -54.99 0.07 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.835 . . . . 0.0 110.219 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 131.68 -103.76 0.55 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -79.38 68.09 5.3 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.395 -1.061 . . . . 0.0 110.21 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.69 -38.1 67.65 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.35 -0.844 . . . . 0.0 110.123 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -166.19 70.48 0.13 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.355 -0.841 . . . . 0.0 110.163 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.3 p -167.13 115.27 0.81 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.427 -0.796 . . . . 0.0 110.178 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.272 179.944 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.468 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 44.6 ttp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.182 0.515 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -92.65 139.42 30.58 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.359 -0.838 . . . . 0.0 109.79 179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.4 pt -137.6 158.18 34.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 110.348 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -112.0 144.36 41.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.567 -0.708 . . . . 0.0 110.779 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 66.7 t -127.79 118.23 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.488 -0.757 . . . . 0.0 109.588 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 34.2 mttt -100.25 129.9 46.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.422 -0.798 . . . . 0.0 110.578 -179.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.54 HG22 ' HB3' ' B' ' 69' ' ' LEU . 40.0 p -96.13 174.98 6.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.377 -0.827 . . . . 0.0 110.136 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.596 HD22 HD23 ' A' ' 24' ' ' LEU . 37.0 mt -61.47 -13.6 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.335 -0.853 . . . . 0.0 111.056 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.2 p -95.72 18.13 13.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.099 -1.0 . . . . 0.0 110.698 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.28 11.62 61.94 Favored Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.0 tttp -84.96 127.76 34.32 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.055 -1.262 . . . . 0.0 109.895 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 5.9 m -112.94 125.15 54.08 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.264 -0.898 . . . . 0.0 110.272 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 31.6 mt -109.51 138.65 35.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.464 -0.773 . . . . 0.0 110.492 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.4 m -102.59 121.21 41.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.461 -0.774 . . . . 0.0 109.452 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.53 HD23 ' HE3' ' B' ' 33' ' ' LYS . 49.1 mt -123.75 161.41 25.23 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.127 -0.983 . . . . 0.0 111.163 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -106.31 114.59 28.8 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.536 -0.727 . . . . 0.0 109.27 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.532 HG12 ' CE ' ' B' ' 29' ' ' LYS . 33.9 m -140.2 175.52 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.282 -0.886 . . . . 0.0 110.85 -179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.63 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.5 mp0 -113.36 165.88 12.38 Favored Pre-proline 0 N--CA 1.489 1.499 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.91 -27.37 17.7 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 O-C-N 123.453 1.238 . . . . 0.0 110.234 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.3 p -84.68 -1.57 56.32 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.144 -0.972 . . . . 0.0 110.518 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -71.26 143.22 50.45 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.213 -0.929 . . . . 0.0 110.477 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 75.9 p -83.24 158.24 22.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.597 -0.689 . . . . 0.0 110.396 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.572 HG23 HD12 ' B' ' 43' ' ' LEU . 42.8 mm -59.71 -37.58 71.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 109.413 179.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -60.0 -34.59 73.54 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.427 -0.796 . . . . 0.0 109.148 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -70.33 -31.86 69.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.546 -0.721 . . . . 0.0 109.198 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.93 -39.77 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.2 mttm -62.85 -41.73 99.47 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.43 -33.2 73.31 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.551 -0.718 . . . . 0.0 109.229 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.532 ' CE ' HG12 ' B' ' 17' ' ' VAL . 7.2 mttp -68.43 -38.56 81.32 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.991 -0.684 . . . . 0.0 109.504 179.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.459 HD13 HD22 ' B' ' 69' ' ' LEU . 12.5 mt -67.41 -40.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.313 -0.867 . . . . 0.0 109.33 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -60.44 -49.36 77.87 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.299 -0.876 . . . . 0.0 109.574 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -58.05 -28.2 64.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.504 -0.747 . . . . 0.0 110.46 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.53 ' HE3' HD23 ' B' ' 15' ' ' LEU . 12.8 mmtt -83.61 -43.11 15.99 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.387 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -108.13 -116.98 0.27 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.36 -0.838 . . . . 0.0 109.842 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -161.67 22.1 0.21 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 83.0 mt -91.94 141.44 25.39 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.149 -1.206 . . . . 0.0 109.982 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.571 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.5 Cg_endo -71.71 139.16 33.27 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.637 1.336 . . . . 0.0 110.217 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.62 -27.16 84.34 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 O-C-N 123.675 1.355 . . . . 0.0 111.075 -179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -68.77 -23.6 64.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.287 -0.883 . . . . 0.0 109.904 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.571 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 5.8 mp0 -100.98 2.79 40.98 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.418 -0.801 . . . . 0.0 110.661 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -94.17 136.51 34.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.178 -0.951 . . . . 0.0 110.5 -179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.4 ttt180 -130.21 128.42 41.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.476 -0.765 . . . . 0.0 109.789 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.909 ' HB3' HD12 ' B' ' 50' ' ' LEU . 19.2 mt -104.54 118.51 36.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.303 -0.873 . . . . 0.0 110.336 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.23 133.67 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.533 -0.729 . . . . 0.0 109.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.5 ' HB2' HD23 ' B' ' 67' ' ' LEU . 31.0 t80 -140.77 152.44 45.23 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.367 -0.833 . . . . 0.0 109.995 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.417 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.14 27.43 0.31 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.459 -0.776 . . . . 0.0 111.118 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.73 1.16 83.07 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -110.95 138.05 47.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -1.21 . . . . 0.0 110.226 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -78.7 136.01 37.32 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.333 -0.854 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.909 HD12 ' HB3' ' B' ' 43' ' ' LEU . 57.5 mt -83.63 139.55 32.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.188 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 129.06 40.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.396 -0.815 . . . . 0.0 110.404 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.478 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 11.8 m-20 -48.4 -27.3 2.53 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.418 -0.801 . . . . 0.0 111.026 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.94 -7.61 86.97 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.118 -1.039 . . . . 0.0 110.564 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.438 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 21.0 mmt180 -99.23 155.8 17.3 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.988 -1.301 . . . . 0.0 110.428 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.3 p -102.2 165.22 11.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.324 -0.86 . . . . 0.0 110.385 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.63 HD12 ' O ' ' B' ' 18' ' ' GLU . 87.9 mt -53.59 -44.6 69.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.358 -0.839 . . . . 0.0 110.673 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.2 t -56.61 -36.49 69.48 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.451 -0.781 . . . . 0.0 110.865 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.89 -27.71 66.94 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.236 -0.915 . . . . 0.0 110.418 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.606 ' CG ' HD22 ' B' ' 50' ' ' LEU . 71.2 m-85 -101.12 25.28 8.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.352 -0.842 . . . . 0.0 110.209 179.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 30.1 m120 50.66 30.94 5.29 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.378 -0.826 . . . . 0.0 110.554 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.621 HD12 ' HA ' ' B' ' 56' ' ' LEU . 89.1 mt -81.38 112.54 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.856 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -105.65 169.35 8.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.366 -0.834 . . . . 0.0 110.191 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 7.5 pttm -46.51 152.7 0.43 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.582 -0.699 . . . . 0.0 110.903 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 61.1 mm-40 63.08 15.42 8.47 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.768 -0.583 . . . . 0.0 110.719 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.92 49.84 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.191 -0.943 . . . . 0.0 110.078 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 17.7 m -107.62 110.74 22.69 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.989 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.5 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.2 mt -102.46 164.29 11.75 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.355 -0.84 . . . . 0.0 110.169 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 67.1 m80 -108.93 132.76 53.76 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.54 ' HB3' HG22 ' B' ' 7' ' ' THR . 57.0 tp -107.3 130.34 54.78 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.23 -0.919 . . . . 0.0 110.478 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 46.7 t -124.96 161.07 29.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.403 -0.811 . . . . 0.0 110.01 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 95.3 mt -93.92 124.72 38.11 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.315 -0.866 . . . . 0.0 110.208 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -87.47 120.05 28.37 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.339 -0.851 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' B' ' 73' ' ' LEU . 31.1 mt -130.6 130.08 43.55 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.335 -0.853 . . . . 0.0 110.244 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 25.9 ttt-85 -110.11 143.01 40.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.279 -0.888 . . . . 0.0 110.212 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -135.41 -98.25 0.56 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.295 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.557 -179.974 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.7 m80 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.247 0.546 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.529 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 57.3 mtp -146.68 -54.79 0.25 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.3 -0.875 . . . . 0.0 110.162 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 2' ' ' MET . 48.4 mt 72.99 41.45 0.5 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.75 -32.07 70.47 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.8 mp -74.76 78.53 2.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -1.041 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -107.38 -145.95 12.49 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -99.7 81.08 2.43 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.386 -1.067 . . . . 0.0 110.328 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.67 25.2 3.58 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.279 -0.888 . . . . 0.0 110.575 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 52.22 27.24 4.51 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.287 -0.883 . . . . 0.0 110.493 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.2 t80 57.47 105.17 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.342 -0.849 . . . . 0.0 110.346 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.36 44.35 1.2 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.324 -0.86 . . . . 0.0 110.306 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -158.23 24.84 0.25 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.306 -0.871 . . . . 0.0 110.238 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -128.51 2.69 6.58 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.965 -1.254 . . . . 0.0 109.965 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.6 m -65.05 -22.94 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.135 -1.215 . . . . 0.0 110.244 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.535 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -159.22 -179.96 1.22 Allowed Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.245 -0.909 . . . . 0.0 110.008 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.724 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 37.3 Cg_endo -61.64 78.87 0.09 OUTLIER 'Trans proline' 0 C--N 1.313 -1.301 0 O-C-N 123.573 1.301 . . . . 0.0 110.662 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.444 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 70.21 46.55 0.6 Allowed 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.99 26.52 0.15 Allowed 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.142 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.404 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 0.6 OUTLIER -169.39 108.54 0.48 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.118 -0.989 . . . . 0.0 110.532 179.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 19' ' ' ASP . 54.9 Cg_endo -73.63 -14.09 24.68 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 124.107 1.583 . . . . 0.0 109.668 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -74.2 -33.32 63.38 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.501 -0.75 . . . . 0.0 109.36 179.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.15 -28.86 34.9 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.55 -0.719 . . . . 0.0 109.23 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.724 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -73.61 -39.24 64.71 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.393 -0.817 . . . . 0.0 109.661 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.692 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -80.72 -30.3 36.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.433 -0.792 . . . . 0.0 109.863 179.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.07 -33.35 71.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.435 HD21 ' HA3' ' B' ' 47' ' ' GLY . 0.6 OUTLIER -82.9 -24.09 33.29 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.399 -0.813 . . . . 0.0 110.285 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -79.81 -31.22 40.68 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.238 -0.914 . . . . 0.0 109.121 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 24' ' ' LEU . 66.2 t -78.75 -27.86 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.682 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.6 p -73.15 -45.76 54.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.423 -0.798 . . . . 0.0 109.988 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -32.98 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.352 -0.843 . . . . 0.0 110.009 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.79 -28.2 61.53 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.367 -0.833 . . . . 0.0 110.153 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.564 ' OE2' HG21 ' B' ' 66' ' ' THR . 0.0 OUTLIER -71.31 -41.94 69.28 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.317 -0.864 . . . . 0.0 110.007 179.887 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.4 -29.18 67.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.347 -0.846 . . . . 0.0 110.024 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.1 -39.47 65.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.875 . . . . 0.0 110.199 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.25 -36.92 85.61 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.387 -0.82 . . . . 0.0 110.184 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -74.78 -47.17 32.36 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.391 -0.818 . . . . 0.0 110.154 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.536 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.0 OUTLIER -68.63 -26.89 65.57 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.436 -0.79 . . . . 0.0 110.036 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -78.95 -53.28 7.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.483 -0.761 . . . . 0.0 109.659 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -54.06 -28.13 36.9 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.234 -0.916 . . . . 0.0 109.121 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -92.72 -33.79 14.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.646 -0.659 . . . . 0.0 109.546 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.536 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.35 -38.56 81.56 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.235 -0.916 . . . . 0.0 109.858 179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -80.78 -35.06 33.65 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.462 -0.774 . . . . 0.0 110.007 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mmm180 -56.61 -41.32 76.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.299 -0.876 . . . . 0.0 109.97 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.13 -28.35 35.14 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.352 -0.842 . . . . 0.0 109.996 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.77 -30.01 59.0 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.497 -0.752 . . . . 0.0 110.106 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.03 -38.44 27.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.86 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.16 -33.74 76.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.49 -0.756 . . . . 0.0 110.241 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.77 -30.61 26.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.384 -0.823 . . . . 0.0 110.23 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.68 65.24 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.357 -0.84 . . . . 0.0 110.243 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.6 56.48 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.34 -0.85 . . . . 0.0 110.537 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -88.93 -67.26 0.85 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.144 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.83 -22.52 18.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.427 -0.795 . . . . 0.0 110.278 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.76 -102.08 0.04 OUTLIER Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.613 HG23 ' O ' ' A' ' 54' ' ' ILE . 6.1 tp -115.05 80.8 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.402 -1.058 . . . . 0.0 110.282 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.6 176.85 1.76 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.214 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 m -62.44 142.66 57.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.454 -0.779 . . . . 0.0 110.137 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 m -98.27 -21.32 16.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.43 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -136.97 94.19 0.22 Allowed Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.2 p -91.62 47.42 1.36 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.33 -1.1 . . . . 0.0 110.233 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -140.43 76.95 1.58 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.339 -0.85 . . . . 0.0 110.106 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.02 -28.93 69.83 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.384 -0.823 . . . . 0.0 110.272 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 2.8 m -123.92 80.83 1.85 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.339 -0.851 . . . . 0.0 110.282 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.13 -36.44 79.71 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.393 -0.817 . . . . 0.0 110.242 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -75.0 -29.04 60.76 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.193 -0.942 . . . . 0.0 109.145 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.451 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -62.06 -44.55 96.43 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.597 -0.841 . . . . 0.0 108.855 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.0 tp -64.78 -28.52 69.63 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.1 tt -74.69 -47.71 30.1 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.52 -0.737 . . . . 0.0 109.875 179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.01 -52.61 8.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.484 -0.76 . . . . 0.0 110.617 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 33.4 ttp -51.89 -38.86 57.76 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.226 -0.921 . . . . 0.0 110.65 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.5 m -70.31 -42.28 72.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.325 -0.86 . . . . 0.0 110.357 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.4 HD12 ' HA ' ' A' ' 71' ' ' ILE . 4.7 tp -81.53 -15.62 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.191 -0.943 . . . . 0.0 110.081 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 18.5 m -74.16 -39.89 62.95 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.394 -0.816 . . . . 0.0 109.672 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -80.88 -29.3 35.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.476 -0.765 . . . . 0.0 109.862 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -81.64 -49.46 10.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.41 -0.806 . . . . 0.0 110.105 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.16 -40.5 96.26 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.301 -0.874 . . . . 0.0 110.012 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -78.57 -23.83 45.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -34.44 86.93 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -79.27 102.26 8.49 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.451 -1.029 . . . . 0.0 110.109 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.02 81.02 1.39 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.292 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -129.03 38.55 2.0 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -170.86 146.17 2.13 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.35 -1.088 . . . . 0.0 108.928 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.44 62.87 2.83 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.506 1.266 . . . . 0.0 110.303 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -57.42 96.06 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.421 -0.799 . . . . 0.0 110.453 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 tp -85.09 -30.13 24.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.392 -0.817 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 61.5 m -71.72 -9.58 58.5 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.426 -0.796 . . . . 0.0 110.538 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.9 t -119.99 23.9 10.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.215 -0.928 . . . . 0.0 110.053 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.9 mtt -116.84 -162.37 0.85 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.425 -0.797 . . . . 0.0 109.898 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 57.1 p -141.51 -174.33 4.01 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.33 -0.856 . . . . 0.0 110.283 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.6 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.9 pt-20 -65.06 -32.77 74.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.548 -0.72 . . . . 0.0 109.356 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.43 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.5 mt-10 -85.32 -41.2 15.72 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 120.074 -0.65 . . . . 0.0 109.362 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -63.95 -39.89 95.18 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -71.8 -35.13 69.89 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.6 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -63.19 -41.1 91.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.846 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.411 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -62.26 -31.11 71.64 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -82.97 -36.06 25.42 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.737 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.98 -35.55 66.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.445 -0.784 . . . . 0.0 110.037 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.1 ppp? -79.22 -25.65 42.62 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.457 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -70.56 -33.78 71.5 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.451 -0.781 . . . . 0.0 109.849 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.19 -30.99 38.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.478 -0.764 . . . . 0.0 110.084 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -74.9 -28.54 60.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.36 -0.837 . . . . 0.0 110.224 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.43 -28.61 31.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.293 -0.88 . . . . 0.0 110.231 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.37 -49.69 7.93 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.305 -0.872 . . . . 0.0 110.151 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 81.07 100.74 0.34 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -152.56 71.57 0.94 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.353 -1.086 . . . . 0.0 110.202 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -116.38 -49.27 2.67 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.303 -0.873 . . . . 0.0 110.222 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -74.66 -49.95 19.47 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.395 -0.816 . . . . 0.0 110.138 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.0 70.41 1.17 Allowed Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -117.44 96.92 5.62 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.345 -1.091 . . . . 0.0 110.189 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -143.03 -66.49 0.38 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.448 -0.782 . . . . 0.0 110.18 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -69.68 -53.24 19.56 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.45 -0.781 . . . . 0.0 110.16 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.2 t -75.37 144.64 42.19 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.262 -0.899 . . . . 0.0 110.136 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.191 179.975 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.334 0.588 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -97.47 146.38 25.28 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.447 -0.783 . . . . 0.0 110.035 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.572 HD13 HG21 ' B' ' 17' ' ' VAL . 24.1 pt -137.53 157.4 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.293 -0.88 . . . . 0.0 110.025 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -111.68 143.59 42.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.686 -0.634 . . . . 0.0 110.638 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 12' ' ' THR . 59.0 t -127.78 118.56 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.42 -0.8 . . . . 0.0 109.405 179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.3 mtpt -100.1 138.05 37.71 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.365 -0.835 . . . . 0.0 110.574 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 42.5 p -96.14 170.13 9.48 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.455 -0.778 . . . . 0.0 110.33 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.62 HD11 HG13 ' B' ' 70' ' ' VAL . 17.5 mt -61.7 -10.58 8.96 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.407 -0.808 . . . . 0.0 111.181 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.3 p -95.29 -24.38 16.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.961 -1.087 . . . . 0.0 110.507 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.6 7.31 10.9 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.189 -1.164 . . . . 0.0 110.189 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.4 tttp -84.64 128.56 34.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.057 -1.26 . . . . 0.0 109.943 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 27.4 m -113.16 125.29 54.18 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 110.198 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.19 135.67 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.334 -0.854 . . . . 0.0 110.41 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 7.1 m -102.43 119.26 38.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.398 -0.814 . . . . 0.0 109.532 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.3 mt -123.58 166.97 14.55 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.107 -0.996 . . . . 0.0 110.859 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -106.5 114.63 28.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 109.382 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.572 HG21 HD13 ' B' ' 3' ' ' ILE . 33.0 m -140.39 169.53 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.262 -0.899 . . . . 0.0 110.991 -179.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.537 ' O ' HD12 ' B' ' 56' ' ' LEU . 27.4 mt-10 -112.46 166.18 11.52 Favored Pre-proline 0 N--CA 1.488 1.447 0 O-C-N 121.512 -0.742 . . . . 0.0 109.101 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.48 -26.44 20.16 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.499 1.263 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.63 -2.4 57.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.133 -0.979 . . . . 0.0 110.474 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -71.28 141.35 50.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.157 -0.964 . . . . 0.0 110.396 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 44.0 p -83.43 157.51 22.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.542 -0.724 . . . . 0.0 110.385 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.574 HG23 HD12 ' B' ' 43' ' ' LEU . 39.9 mm -59.55 -31.18 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.259 -0.901 . . . . 0.0 109.529 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.93 -36.91 85.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.486 -0.759 . . . . 0.0 109.377 179.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -70.33 -32.89 70.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.486 -0.759 . . . . 0.0 109.206 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.02 -39.86 77.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.434 -0.791 . . . . 0.0 109.126 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.456 ' HE2' HG22 ' B' ' 23' ' ' ILE . 6.4 mttm -63.02 -42.39 99.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.49 -0.756 . . . . 0.0 109.147 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.46 -34.01 74.72 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.538 -0.726 . . . . 0.0 109.392 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 12.5 mttm -68.31 -39.74 81.93 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.459 -0.776 . . . . 0.0 109.616 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.473 HD13 HD22 ' B' ' 69' ' ' LEU . 13.3 mt -67.2 -38.8 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.373 -0.829 . . . . 0.0 109.248 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.68 -52.41 65.24 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.473 -0.767 . . . . 0.0 109.768 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -58.09 -26.69 62.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.412 -0.805 . . . . 0.0 110.575 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.1 mmtm -83.97 -39.01 20.25 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.25 -0.906 . . . . 0.0 110.986 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -107.97 -54.89 2.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.208 -0.933 . . . . 0.0 110.501 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.75 14.28 2.34 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.492 HG23 ' HD2' ' B' ' 37' ' ' PRO . 23.0 mt -91.28 143.35 28.17 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.007 -1.29 . . . . 0.0 109.756 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.3 Cg_endo -69.88 137.06 34.23 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 O-C-N 123.665 1.35 . . . . 0.0 110.501 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.77 -27.04 84.16 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 O-C-N 123.728 1.383 . . . . 0.0 111.197 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.65 -22.62 64.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.262 -0.899 . . . . 0.0 109.88 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.531 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.5 mp0 -101.12 -1.87 32.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.417 -0.802 . . . . 0.0 110.518 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.01 140.95 29.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.181 -0.949 . . . . 0.0 110.492 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.13 127.62 40.14 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.422 -0.799 . . . . 0.0 109.853 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.773 ' C ' HD12 ' B' ' 44' ' ' ILE . 19.2 mt -104.58 118.17 35.92 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.93 . . . . 0.0 110.223 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.773 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.2 137.95 53.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.493 -0.755 . . . . 0.0 109.821 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -140.79 147.83 39.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.438 -0.789 . . . . 0.0 109.795 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 29.05 0.54 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.407 -0.808 . . . . 0.0 111.191 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.435 ' HA3' HD21 ' A' ' 26' ' ' LEU . . . 78.13 6.01 87.41 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 110.621 -0.991 . . . . 0.0 110.621 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mtmm -110.96 134.44 52.58 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.054 -1.262 . . . . 0.0 110.293 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.38 131.07 36.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.866 . . . . 0.0 109.542 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.708 HD12 ' HB3' ' B' ' 43' ' ' LEU . 38.7 mt -83.65 135.55 34.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.227 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -93.5 132.88 37.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.396 -0.815 . . . . 0.0 110.578 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.452 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.2 m-20 -48.38 -26.29 2.0 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.588 -0.695 . . . . 0.0 111.165 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.8 -7.81 86.8 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.5 mmt-85 -99.54 154.23 18.41 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.266 . . . . 0.0 110.494 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 23.3 p -102.4 164.18 11.81 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.374 -0.828 . . . . 0.0 110.174 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.544 ' HA ' HD12 ' B' ' 61' ' ' ILE . 92.8 mt -53.53 -43.35 68.29 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.266 -0.896 . . . . 0.0 110.671 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 13.2 t -56.81 -36.24 69.7 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.402 -0.811 . . . . 0.0 110.971 -179.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.62 -27.75 66.59 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.231 -0.918 . . . . 0.0 110.398 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.599 ' CG ' HD22 ' B' ' 50' ' ' LEU . 80.3 m-85 -100.92 25.83 7.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.228 -0.92 . . . . 0.0 110.068 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 50.65 30.31 4.8 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.806 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.589 HD13 HD21 ' B' ' 67' ' ' LEU . 90.9 mt -81.35 113.07 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.402 -0.811 . . . . 0.0 109.934 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -105.58 171.82 7.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.452 -0.78 . . . . 0.0 110.179 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 pttp -46.51 152.39 0.46 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.487 -0.758 . . . . 0.0 111.0 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 5.1 mt-10 62.74 16.35 8.9 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.693 -0.63 . . . . 0.0 110.639 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.69 142.05 49.85 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.041 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . 0.564 HG21 ' OE2' ' A' ' 32' ' ' GLU . 25.3 m -107.62 111.1 23.17 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.344 -0.848 . . . . 0.0 109.977 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.589 HD21 HD13 ' B' ' 61' ' ' ILE . 1.3 mt -102.55 164.92 11.38 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.325 -0.86 . . . . 0.0 110.13 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.497 ' CD2' HG12 ' A' ' 28' ' ' VAL . 71.3 m80 -108.79 132.37 54.05 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.301 -0.874 . . . . 0.0 110.186 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.473 HD22 HD13 ' B' ' 30' ' ' ILE . 59.6 tp -107.3 131.4 54.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.346 -0.846 . . . . 0.0 110.255 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.62 HG13 HD11 ' B' ' 8' ' ' LEU . 39.5 t -124.88 152.53 31.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.363 -0.836 . . . . 0.0 110.09 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 89.0 mt -94.33 133.6 37.71 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.458 -0.776 . . . . 0.0 110.188 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 56.5 ttt-85 -86.68 135.84 33.25 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.342 -0.849 . . . . 0.0 110.236 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.2 mt -97.51 -175.55 3.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.408 -0.807 . . . . 0.0 110.127 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -128.48 77.05 1.75 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.327 -0.858 . . . . 0.0 110.238 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 145.32 151.36 5.4 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 CA-C-O 118.009 -1.439 . . . . 0.0 109.522 -179.994 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 24.7 t60 . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.19 0.519 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.579 ' C ' HD12 ' A' ' 3' ' ' LEU . 4.6 mmm -128.6 175.42 8.58 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.379 -0.825 . . . . 0.0 110.305 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.579 HD12 ' C ' ' A' ' 2' ' ' MET . 10.6 mp -112.25 24.72 12.27 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.509 -0.744 . . . . 0.0 109.588 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.09 -30.76 41.09 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.7 mp -106.49 40.09 1.69 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.365 -1.08 . . . . 0.0 110.169 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -154.15 152.06 23.68 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.98 32.76 13.31 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.408 -1.054 . . . . 0.0 110.432 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.3 p 50.42 32.0 6.01 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.439 -0.788 . . . . 0.0 110.624 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.9 t0 52.2 30.51 7.87 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.453 -0.779 . . . . 0.0 110.533 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 57.95 104.94 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.29 -0.881 . . . . 0.0 110.348 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -98.16 82.24 2.91 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.29 -0.882 . . . . 0.0 110.244 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -154.84 43.27 0.48 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.31 -0.869 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 125.05 -52.73 0.79 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.34 -27.85 42.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.404 -1.057 . . . . 0.0 110.218 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -104.39 153.56 38.98 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.36 -0.837 . . . . 0.0 110.237 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.72 -16.16 29.98 Favored 'Trans proline' 0 C--N 1.309 -1.529 0 O-C-N 123.853 1.449 . . . . 0.0 110.753 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.84 -10.35 59.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.281 -0.887 . . . . 0.0 110.541 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.36 8.71 38.12 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.129 -0.982 . . . . 0.0 110.533 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.54 119.2 0.57 Allowed Pre-proline 0 N--CA 1.489 1.512 0 O-C-N 121.187 -0.946 . . . . 0.0 109.743 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.39 -15.75 38.66 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 O-C-N 123.97 1.511 . . . . 0.0 110.154 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.647 ' HB2' HG13 ' B' ' 70' ' ' VAL . 14.8 pt-20 -75.21 -29.79 60.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.406 -0.809 . . . . 0.0 109.426 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 tp -89.46 -31.16 17.82 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.553 -0.717 . . . . 0.0 109.259 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.65 72.58 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.547 -0.721 . . . . 0.0 109.223 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.5 tp -76.58 -38.62 54.62 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.538 -0.726 . . . . 0.0 109.482 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.04 -29.75 71.07 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.394 -0.816 . . . . 0.0 109.53 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.693 HD21 ' O ' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -82.95 -21.28 34.11 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.591 -0.693 . . . . 0.0 110.211 179.703 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -84.25 -32.23 24.55 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.334 -0.854 . . . . 0.0 109.709 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.0 t -78.45 -38.2 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.451 -0.78 . . . . 0.0 109.907 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.3 m -72.86 -41.98 64.17 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.849 . . . . 0.0 109.903 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 20.9 ttt -62.3 -35.92 80.52 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.372 -0.83 . . . . 0.0 109.957 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -69.78 -36.71 75.96 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 109.945 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.19 -44.43 83.99 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.382 -0.824 . . . . 0.0 110.046 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.06 -34.83 77.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.357 -0.839 . . . . 0.0 110.091 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -41.94 81.4 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.36 -0.838 . . . . 0.0 109.923 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.13 -33.44 70.87 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.472 -0.768 . . . . 0.0 109.9 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -47.05 13.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.386 -0.821 . . . . 0.0 109.97 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.695 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 6.7 tm0? -58.88 -32.67 69.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.845 . . . . 0.0 110.039 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -83.93 -57.78 3.06 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.475 -0.766 . . . . 0.0 109.666 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -52.6 -34.72 52.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.471 -0.768 . . . . 0.0 109.327 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -81.78 -32.84 31.21 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.551 -0.718 . . . . 0.0 109.076 178.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.695 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -65.63 -45.17 84.1 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.776 -0.769 . . . . 0.0 109.694 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -76.79 -31.99 57.36 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.375 -0.828 . . . . 0.0 109.882 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -53.97 -41.27 67.67 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.328 -0.858 . . . . 0.0 109.333 179.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.79 -28.72 40.25 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.14 -28.35 69.58 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.609 -0.682 . . . . 0.0 109.687 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.32 -46.87 9.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.498 -0.751 . . . . 0.0 110.025 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.79 -30.12 71.11 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 109.982 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.1 m -79.33 -40.99 28.96 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.401 -0.812 . . . . 0.0 110.285 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.27 -25.12 66.88 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.393 -0.817 . . . . 0.0 110.291 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.38 30.98 2.35 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.321 -0.862 . . . . 0.0 110.251 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -147.1 -48.38 0.18 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.387 -0.82 . . . . 0.0 110.207 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -140.25 30.94 1.95 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.329 -0.857 . . . . 0.0 110.244 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -119.5 -66.86 0.29 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.8 pt -116.36 62.64 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.362 -1.081 . . . . 0.0 110.135 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.41 133.8 35.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.368 -0.832 . . . . 0.0 110.369 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 25.4 p -101.24 83.71 2.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.127 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.5 m -135.73 -47.44 0.68 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.33 -0.856 . . . . 0.0 110.211 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.75 87.53 0.1 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.1 t -117.18 55.09 0.85 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.45 -1.03 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.76 93.87 4.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.296 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.12 -60.63 1.73 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.142 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.0 m -119.49 74.75 1.02 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.367 -0.833 . . . . 0.0 110.062 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -69.94 -35.91 74.89 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.416 -0.803 . . . . 0.0 110.319 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.84 -32.08 57.31 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.252 -0.905 . . . . 0.0 109.29 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.28 82.72 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 119.49 -0.884 . . . . 0.0 108.784 179.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -70.51 -29.43 65.93 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.452 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.0 tt -76.88 -40.89 45.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.55 -0.719 . . . . 0.0 109.874 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HA ' HG22 ' A' ' 71' ' ' ILE . 4.0 tptt -82.97 -50.17 8.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.403 -0.811 . . . . 0.0 110.529 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.5 tpt -57.46 -40.59 78.82 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.118 -0.989 . . . . 0.0 110.538 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 85.6 m -69.72 -40.57 76.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.271 -0.893 . . . . 0.0 110.414 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.3 tp -83.66 -16.5 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 O-C-N 121.215 -0.928 . . . . 0.0 110.288 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -73.91 -42.03 61.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.252 -0.905 . . . . 0.0 109.782 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -81.51 -26.12 35.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.44 -0.787 . . . . 0.0 110.026 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -83.83 -48.14 10.37 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.444 -0.785 . . . . 0.0 110.237 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -65.26 -30.47 71.35 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.056 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -88.21 115.48 25.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.365 -0.834 . . . . 0.0 110.221 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.11 -59.91 0.06 OUTLIER Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.26 106.08 4.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.414 -1.05 . . . . 0.0 110.199 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.5 m -113.83 32.55 5.76 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.331 -0.856 . . . . 0.0 110.227 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.76 10.37 74.98 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 110.004 -1.239 . . . . 0.0 110.004 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.25 151.42 1.66 Allowed Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.136 -1.214 . . . . 0.0 108.94 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -76.77 37.95 0.6 Allowed 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 123.524 1.276 . . . . 0.0 110.762 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 50.72 47.26 24.75 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.129 -0.982 . . . . 0.0 110.632 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.0 tp -90.6 -27.15 19.28 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.198 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 80.4 p -58.68 -22.74 57.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.332 -0.855 . . . . 0.0 110.431 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -91.83 -26.96 18.27 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.295 -0.878 . . . . 0.0 110.189 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 32.1 mtt -69.36 121.59 17.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.8 p -78.23 -164.59 0.56 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.423 -0.798 . . . . 0.0 110.435 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 pt-20 -66.1 -32.42 73.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.617 -0.677 . . . . 0.0 109.317 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.441 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.2 mp0 -85.3 -40.36 16.65 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.26 -41.43 99.04 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -71.14 -35.4 71.68 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.568 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.9 -38.7 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.26 -34.42 78.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.455 -0.778 . . . . 0.0 109.736 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -80.0 -44.23 20.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.417 -0.802 . . . . 0.0 110.16 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.32 -31.7 67.72 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.385 -0.822 . . . . 0.0 110.294 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.557 ' HG3' HD12 ' A' ' 101' ' ' LEU . 56.2 tpp -82.54 -20.81 35.89 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.365 -0.835 . . . . 0.0 109.981 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -38.82 55.64 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.368 -0.832 . . . . 0.0 110.096 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 79.9 mtp -84.79 -25.14 28.38 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.393 -0.817 . . . . 0.0 110.292 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.8 m -79.5 -33.35 42.24 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.285 -0.884 . . . . 0.0 110.325 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.557 HD12 ' HG3' ' A' ' 97' ' ' MET . 14.6 mt -76.38 -35.49 58.62 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.3 -0.875 . . . . 0.0 110.276 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 41.5 mm-40 -107.65 36.18 2.83 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.288 -0.883 . . . . 0.0 110.231 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -114.34 -133.12 5.53 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.588 ' HB1' ' CG ' ' A' ' 108' ' ' GLN . . . -128.18 67.95 1.35 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.304 -1.115 . . . . 0.0 110.22 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.23 32.38 4.48 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.34 -0.85 . . . . 0.0 110.103 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -166.11 83.0 0.3 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -0.847 . . . . 0.0 110.258 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 136.46 -30.47 2.69 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.588 ' CG ' ' HB1' ' A' ' 104' ' ' ALA . 0.1 OUTLIER -145.82 69.74 1.22 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.424 -1.044 . . . . 0.0 110.273 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.74 -62.41 0.11 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.289 -0.882 . . . . 0.0 110.255 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -85.92 -28.75 24.12 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.31 -0.869 . . . . 0.0 110.25 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 28.5 t -73.09 -39.38 65.86 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.395 -0.816 . . . . 0.0 110.208 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.248 179.974 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.438 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.153 0.501 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -87.65 140.42 29.54 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.371 -0.831 . . . . 0.0 109.882 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 20.1 pt -137.64 159.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -0.859 . . . . 0.0 110.614 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.406 ' CE2' ' OG1' ' B' ' 14' ' ' THR . 81.1 m-85 -111.96 142.19 44.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.647 -0.658 . . . . 0.0 110.551 -179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.3 t -128.17 125.08 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.431 -0.793 . . . . 0.0 109.723 179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.23 130.12 46.32 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.439 -0.788 . . . . 0.0 110.514 -179.652 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.595 HG22 HD23 ' B' ' 69' ' ' LEU . 19.7 p -95.79 177.66 5.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.43 -0.794 . . . . 0.0 110.401 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.44 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -16.19 42.18 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.431 -0.793 . . . . 0.0 111.007 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.9 19.59 11.24 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.038 -1.039 . . . . 0.0 110.693 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.9 12.8 58.17 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.2 OUTLIER -84.92 133.37 34.29 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.073 -1.251 . . . . 0.0 109.825 179.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.423 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 10.3 m -113.21 125.59 54.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 16.2 mt -109.13 136.67 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.384 -0.823 . . . . 0.0 110.466 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.406 ' OG1' ' CE2' ' B' ' 4' ' ' PHE . 11.4 m -102.19 118.52 37.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.412 -0.805 . . . . 0.0 109.222 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.0 mt -123.27 165.29 17.19 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.137 -0.977 . . . . 0.0 110.883 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -106.35 117.12 33.21 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.381 -0.825 . . . . 0.0 109.743 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.546 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.4 m -140.42 176.21 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.331 -0.856 . . . . 0.0 110.712 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.561 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.8 mp0 -113.06 163.86 16.98 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.571 -0.706 . . . . 0.0 109.137 178.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.06 -27.17 17.45 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.507 1.267 . . . . 0.0 110.332 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.3 p -84.71 -3.11 58.4 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.099 -1.0 . . . . 0.0 110.704 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -71.38 140.08 50.02 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.097 -1.002 . . . . 0.0 110.687 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.43 161.37 21.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.551 -0.718 . . . . 0.0 110.371 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 1.081 HG23 HD12 ' B' ' 43' ' ' LEU . 1.7 mp -59.14 -34.03 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 109.733 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -60.61 -37.76 82.5 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.194 -0.941 . . . . 0.0 109.339 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -31.24 68.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.445 -0.784 . . . . 0.0 109.425 179.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 88.3 t -70.28 -42.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.411 -0.806 . . . . 0.0 109.38 179.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.501 ' HE3' HG22 ' B' ' 23' ' ' ILE . 34.8 mttt -63.0 -41.77 99.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.474 -0.766 . . . . 0.0 109.251 179.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -35.22 76.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.446 -0.784 . . . . 0.0 109.282 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.546 ' CD ' HG12 ' B' ' 17' ' ' VAL . 8.4 mttm -68.3 -38.18 81.37 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.52 -0.737 . . . . 0.0 109.661 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 8.6 mt -67.3 -40.31 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.103 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.52 -49.63 76.79 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.449 -0.782 . . . . 0.0 109.462 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.12 -26.53 62.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.326 -0.859 . . . . 0.0 110.314 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -83.91 -41.24 17.62 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.406 -0.809 . . . . 0.0 110.739 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -108.06 -56.1 2.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.264 -0.898 . . . . 0.0 110.417 -179.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.57 19.57 1.65 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 110.321 -1.111 . . . . 0.0 110.321 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.504 HG23 ' HD2' ' B' ' 37' ' ' PRO . 22.6 mt -91.31 143.89 28.95 Favored Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.061 -1.258 . . . . 0.0 109.644 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.504 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.3 Cg_endo -68.2 133.64 29.18 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.614 1.323 . . . . 0.0 110.482 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.77 -23.81 77.35 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 O-C-N 123.79 1.416 . . . . 0.0 110.991 -179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.82 -23.77 64.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.252 -0.905 . . . . 0.0 109.762 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.503 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.4 mp0 -100.38 0.63 40.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.428 -0.795 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -94.22 137.61 33.2 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.198 -0.939 . . . . 0.0 110.407 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -130.12 132.01 45.94 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 1.081 HD12 HG23 ' B' ' 23' ' ' ILE . 39.2 mt -104.79 118.03 35.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.398 -0.814 . . . . 0.0 110.673 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.78 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.33 133.41 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.5 -0.75 . . . . 0.0 109.797 179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 11.4 t80 -141.25 155.54 46.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.397 -0.814 . . . . 0.0 109.977 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.426 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 44.7 24.75 0.11 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.424 -0.797 . . . . 0.0 111.558 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.693 ' O ' HD21 ' A' ' 26' ' ' LEU . . . 84.8 -8.86 67.56 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.119 -1.039 . . . . 0.0 110.851 179.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' B' ' 45' ' ' PHE . 9.2 ptmt -110.69 142.14 43.0 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.809 -1.406 . . . . 0.0 110.484 -179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.4 137.26 37.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.346 -0.846 . . . . 0.0 109.908 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.797 HD22 ' CG ' ' B' ' 59' ' ' TYR . 24.9 mt -83.79 148.84 26.8 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.333 -0.854 . . . . 0.0 110.346 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -93.48 130.25 39.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.298 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.2 m-20 -48.56 -28.13 3.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.494 -0.754 . . . . 0.0 111.079 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.9 -3.05 90.66 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 110.511 -1.035 . . . . 0.0 110.511 -179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.405 ' O ' HD13 ' B' ' 23' ' ' ILE . 12.2 mmt180 -99.49 155.99 17.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.126 -1.22 . . . . 0.0 110.346 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.55 163.19 12.36 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.388 -0.82 . . . . 0.0 110.182 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.581 ' HA ' HD12 ' B' ' 61' ' ' ILE . 85.9 mt -53.24 -45.74 68.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.281 -0.887 . . . . 0.0 110.574 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 15.5 t -56.93 -35.89 69.58 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.415 -0.803 . . . . 0.0 110.838 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -59.6 -29.43 67.97 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.307 -0.871 . . . . 0.0 110.44 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.797 ' CG ' HD22 ' B' ' 50' ' ' LEU . 41.8 m-85 -101.07 28.48 5.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.352 -0.843 . . . . 0.0 109.977 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 26.2 m-20 50.7 28.23 3.45 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.512 -0.743 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.702 HD13 HD21 ' B' ' 67' ' ' LEU . 88.0 mt -81.47 110.19 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.394 -0.816 . . . . 0.0 109.876 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -105.62 172.48 6.77 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.282 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.3 pttt -46.62 151.97 0.52 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.477 -0.765 . . . . 0.0 110.995 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 4.0 mm-40 62.76 15.94 8.57 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.783 -0.573 . . . . 0.0 110.623 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.61 145.23 49.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.929 . . . . 0.0 110.162 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 39.8 m -107.76 109.78 21.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.842 . . . . 0.0 110.082 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.702 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.29 161.58 13.58 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.345 -0.847 . . . . 0.0 110.043 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -108.64 132.01 54.32 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 109.909 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.595 HD23 HG22 ' B' ' 7' ' ' THR . 32.9 tp -107.05 136.09 47.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.318 -0.864 . . . . 0.0 110.165 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.647 HG13 ' HB2' ' A' ' 21' ' ' GLU . 21.3 t -124.77 149.68 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.862 . . . . 0.0 109.953 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 60.1 mt -94.35 119.05 32.53 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.496 -0.752 . . . . 0.0 110.22 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.435 ' HB2' ' HA ' ' B' ' 40' ' ' GLN . 0.0 OUTLIER -75.84 85.46 2.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.315 -0.866 . . . . 0.0 110.149 179.903 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 mt -60.65 111.25 1.54 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.432 -0.793 . . . . 0.0 110.246 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ttp85 -104.33 86.0 2.46 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.16 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -168.87 -102.48 0.16 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 118.011 -1.439 . . . . 0.0 109.537 179.994 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.226 0.536 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 6.7 mmm -143.48 -176.07 4.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.357 -0.839 . . . . 0.0 110.102 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.571 HD12 ' O ' ' A' ' 3' ' ' LEU . 2.5 pp -110.3 18.88 19.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.46 -0.775 . . . . 0.0 109.847 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.42 66.13 3.73 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.57 14.91 19.03 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 110.492 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.11 32.6 0.16 Allowed Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.25 -47.33 9.53 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.288 -1.125 . . . . 0.0 110.183 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 93.3 p -101.29 31.37 3.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -0.841 . . . . 0.0 110.22 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.21 -23.56 24.72 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.333 -0.854 . . . . 0.0 110.388 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.575 ' HB2' HG12 ' A' ' 14' ' ' VAL . 40.2 p90 -162.56 122.23 2.32 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.28 -0.887 . . . . 0.0 110.3 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -166.53 34.45 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.849 . . . . 0.0 110.271 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -170.42 -39.95 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.312 -0.868 . . . . 0.0 110.459 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -102.65 8.37 54.56 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.575 HG12 ' HB2' ' A' ' 10' ' ' PHE . 34.4 m -60.56 -35.4 63.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.087 -1.243 . . . . 0.0 110.263 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.404 ' N ' HG23 ' A' ' 14' ' ' VAL . 1.9 m-20 -97.54 156.21 36.39 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.502 -0.749 . . . . 0.0 110.218 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.47 -16.58 30.75 Favored 'Trans proline' 0 C--N 1.308 -1.564 0 O-C-N 123.741 1.39 . . . . 0.0 110.808 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.81 -10.74 60.16 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.232 -0.917 . . . . 0.0 110.541 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.82 1.42 50.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.159 -0.963 . . . . 0.0 110.739 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -168.05 117.23 0.65 Allowed Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.128 -0.983 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -70.09 -14.58 35.21 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 123.918 1.483 . . . . 0.0 110.03 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.687 ' HB3' HG11 ' B' ' 70' ' ' VAL . 16.6 mt-10 -74.46 -34.09 63.06 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 109.333 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 22' ' ' LEU . 16.4 mt -82.48 -29.44 30.56 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.628 -0.67 . . . . 0.0 109.326 179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.31 -34.34 65.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.453 -0.779 . . . . 0.0 109.551 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.661 ' O ' HG23 ' A' ' 28' ' ' VAL . 5.3 mt -81.89 -32.86 30.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.408 -0.808 . . . . 0.0 109.566 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' B' ' 44' ' ' ILE . . . -66.51 -32.65 74.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.475 -0.766 . . . . 0.0 109.798 179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.43 HD22 ' HA ' ' A' ' 26' ' ' LEU . 0.2 OUTLIER -82.74 -24.99 33.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.382 -0.824 . . . . 0.0 110.229 179.771 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.79 -26.95 29.18 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.663 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 24' ' ' LEU . 83.1 t -85.76 -40.62 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.46 -0.775 . . . . 0.0 109.984 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.6 m -69.76 -38.75 76.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.332 -0.855 . . . . 0.0 110.159 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -43.65 66.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.268 -0.895 . . . . 0.0 110.131 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.74 -37.51 86.56 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.397 -0.815 . . . . 0.0 109.939 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.01 -42.51 76.31 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.823 . . . . 0.0 110.022 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -64.95 -32.2 73.8 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.367 -0.833 . . . . 0.0 110.061 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.18 -42.57 84.02 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.332 -0.855 . . . . 0.0 109.933 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -31.14 71.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.327 -0.858 . . . . 0.0 109.91 179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -40.96 24.72 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.065 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.571 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.2 tp60 -73.62 -21.79 60.21 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.432 -0.793 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -83.76 -53.73 5.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.382 -0.824 . . . . 0.0 109.542 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.65 -29.26 51.91 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.313 -0.867 . . . . 0.0 109.102 179.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -89.91 -35.82 15.38 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.645 -0.659 . . . . 0.0 109.888 179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.96 -38.79 79.61 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 110.163 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.0 mtt180 -78.33 -34.79 48.37 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.437 -0.789 . . . . 0.0 110.186 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.8 ttp85 -59.32 -40.62 86.86 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -0.89 . . . . 0.0 109.835 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.88 -29.33 60.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.47 -0.769 . . . . 0.0 109.779 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.11 -26.98 59.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.427 -0.795 . . . . 0.0 110.076 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.85 -43.96 17.53 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.392 -0.817 . . . . 0.0 110.148 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.93 -32.99 65.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.31 -0.869 . . . . 0.0 110.11 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 m -77.04 -44.09 32.1 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.379 -0.826 . . . . 0.0 110.106 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.24 -28.58 69.79 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 110.12 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -96.47 26.84 4.12 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.428 -0.795 . . . . 0.0 110.123 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -145.0 -49.06 0.24 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.3 -0.875 . . . . 0.0 110.013 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -117.55 22.93 12.09 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.382 -0.823 . . . . 0.0 110.255 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -166.71 41.09 0.26 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.8 tp -64.58 -23.88 34.39 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.321 -1.105 . . . . 0.0 110.223 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.72 69.73 1.12 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.305 -0.872 . . . . 0.0 110.166 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.4 p -86.15 135.13 33.71 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.336 -0.853 . . . . 0.0 110.244 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.545 HG23 ' O ' ' A' ' 57' ' ' THR . 9.9 t -81.52 121.84 26.8 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.398 -0.813 . . . . 0.0 110.291 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.24 -81.62 0.04 OUTLIER Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.394 -1.483 . . . . 0.0 109.394 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.6 p -128.36 92.19 3.39 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.434 -1.039 . . . . 0.0 110.093 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -105.31 67.57 0.78 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.468 -0.77 . . . . 0.0 110.193 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.35 -42.09 14.89 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.35 -0.844 . . . . 0.0 110.15 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 m -92.6 70.88 4.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.343 -0.848 . . . . 0.0 110.126 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -56.75 -29.53 62.65 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.326 -0.859 . . . . 0.0 110.253 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -76.31 -30.13 57.6 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.222 -0.924 . . . . 0.0 109.119 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.44 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.883 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mp -64.99 -29.06 69.96 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 tt -76.44 -37.57 56.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.518 -0.739 . . . . 0.0 109.769 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.435 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.8 OUTLIER -83.51 -55.84 4.07 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.297 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.2 tpt -52.12 -45.35 64.91 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.203 -0.936 . . . . 0.0 110.524 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 96.0 m -66.22 -42.64 88.4 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.343 -0.848 . . . . 0.0 110.474 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.435 HG22 ' HA ' ' A' ' 68' ' ' LYS . 4.5 tp -82.78 -6.39 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.14 -0.975 . . . . 0.0 110.368 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -82.26 -46.68 13.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.199 -0.938 . . . . 0.0 110.044 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -83.74 -20.88 32.6 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.362 -0.836 . . . . 0.0 110.433 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -88.51 -40.26 13.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.465 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.402 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.4 tm-20 -75.3 -36.05 61.18 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.268 -0.895 . . . . 0.0 110.367 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -64.25 -75.23 0.09 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.311 -0.868 . . . . 0.0 110.201 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 64.82 -80.87 0.06 OUTLIER Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -154.96 71.61 0.8 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.381 -1.07 . . . . 0.0 110.123 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -53.28 -25.34 14.26 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.401 -0.812 . . . . 0.0 109.775 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.442 ' O ' ' CG ' ' A' ' 81' ' ' LEU . . . 141.73 -102.42 0.3 Allowed Glycine 0 N--CA 1.487 2.051 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.489 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER 179.61 53.65 0.05 OUTLIER Pre-proline 0 C--N 1.308 -1.213 0 O-C-N 121.547 -0.973 . . . . 0.0 108.959 179.717 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 81' ' ' LEU . 43.1 Cg_endo -69.2 -8.47 23.69 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 O-C-N 123.978 1.515 . . . . 0.0 108.591 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -65.31 83.75 0.05 Allowed 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.164 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 5.1 mt -81.59 -25.22 35.94 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.33 -0.856 . . . . 0.0 110.444 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 19.4 m -60.35 -18.85 52.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.31 -0.869 . . . . 0.0 110.671 -179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.7 m -113.15 22.42 14.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.165 -0.96 . . . . 0.0 110.085 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 29.2 mtt -102.33 123.12 45.56 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.447 -0.783 . . . . 0.0 110.173 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 74.7 p -74.55 -166.29 0.43 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.385 -0.822 . . . . 0.0 110.38 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.527 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.0 pt-20 -68.61 -28.85 67.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.582 -0.699 . . . . 0.0 109.279 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.437 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 33.6 mt-10 -85.61 -40.68 15.97 Favored 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 179.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -64.85 -43.71 92.13 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -66.74 -34.12 77.13 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.527 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.41 -35.75 73.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -38.44 91.19 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.486 -0.759 . . . . 0.0 109.485 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.68 -42.54 64.17 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -65.47 -41.94 92.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.46 -0.775 . . . . 0.0 110.018 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 34.6 mmm -75.53 -22.41 57.1 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.419 -0.801 . . . . 0.0 109.612 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.28 -49.22 70.37 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.545 -0.722 . . . . 0.0 109.902 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 31.0 mtm -70.27 -30.96 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.472 -0.767 . . . . 0.0 110.077 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.95 -25.73 61.99 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.443 -0.786 . . . . 0.0 110.12 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 24.5 mt -91.75 -9.73 42.59 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.383 -0.823 . . . . 0.0 110.664 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -55.89 -26.1 45.78 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.16 -0.962 . . . . 0.0 110.366 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -97.81 38.44 3.09 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -155.92 81.46 1.01 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.324 -1.103 . . . . 0.0 110.219 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -103.95 -47.05 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.337 -0.852 . . . . 0.0 110.243 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.34 -68.15 0.93 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.174 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.97 47.47 0.26 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.436 -1.465 . . . . 0.0 109.436 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.94 103.1 6.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.341 -1.093 . . . . 0.0 110.118 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -126.87 43.26 3.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.82 . . . . 0.0 110.213 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.14 28.38 4.06 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.049 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.58 -35.46 4.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.439 -0.788 . . . . 0.0 110.198 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.204 0.526 . . . . 0.0 110.35 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.67 134.42 47.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.409 -0.807 . . . . 0.0 109.555 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 13.2 pt -136.9 155.6 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 109.943 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -111.64 144.28 41.16 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.559 -0.713 . . . . 0.0 111.04 -179.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.2 t -127.82 117.77 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.476 -0.765 . . . . 0.0 109.262 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.29 133.95 43.95 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.507 -0.746 . . . . 0.0 110.894 -179.219 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 72.1 p -96.4 172.08 8.17 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.531 -0.731 . . . . 0.0 110.115 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 39.7 mt -61.7 -11.58 12.57 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.405 -0.809 . . . . 0.0 111.017 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.4 p -95.61 0.22 52.59 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.015 -1.053 . . . . 0.0 110.909 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.46 9.11 67.26 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.5 tttp -84.61 126.09 33.04 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.089 -1.242 . . . . 0.0 109.859 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.0 m -112.97 123.39 50.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.303 -0.873 . . . . 0.0 110.284 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.404 HD13 HG21 ' B' ' 13' ' ' ILE . 17.9 mt -109.23 136.58 44.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.534 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.5 m -102.25 119.47 38.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.432 -0.792 . . . . 0.0 109.377 179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.2 mt -123.69 162.42 23.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.149 -0.969 . . . . 0.0 111.023 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.438 ' HA ' ' O ' ' B' ' 1' ' ' MET . 3.4 mm-40 -106.32 118.89 37.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.542 -0.724 . . . . 0.0 109.262 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.4 m -140.4 178.65 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.157 -0.964 . . . . 0.0 111.333 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.489 ' O ' HD12 ' B' ' 56' ' ' LEU . 4.2 mm-40 -113.57 159.8 34.1 Favored Pre-proline 0 N--CA 1.489 1.486 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -73.69 -24.95 15.25 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 O-C-N 123.403 1.212 . . . . 0.0 110.041 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.8 -4.62 59.15 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.241 -0.912 . . . . 0.0 110.328 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -71.14 144.99 50.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.176 -0.952 . . . . 0.0 110.573 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 71.8 p -83.25 158.24 22.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.484 -0.76 . . . . 0.0 110.329 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.525 ' CG2' HD12 ' B' ' 43' ' ' LEU . 46.0 mm -59.75 -32.31 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.841 . . . . 0.0 109.505 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -62.73 -36.96 84.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.421 -0.799 . . . . 0.0 109.251 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.3 -32.01 69.59 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.506 -0.746 . . . . 0.0 109.162 179.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.427 HG21 HD21 ' B' ' 56' ' ' LEU . 58.4 t -70.13 -41.18 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.466 -0.771 . . . . 0.0 109.223 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -62.96 -41.64 99.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 109.151 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.57 -34.4 75.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.744 . . . . 0.0 109.422 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 mttp -68.03 -39.01 83.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.529 -0.732 . . . . 0.0 109.459 179.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.0 mt -66.94 -38.73 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.315 -0.866 . . . . 0.0 109.098 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -49.56 77.07 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.448 -0.782 . . . . 0.0 109.457 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.24 -27.21 63.75 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.516 -0.74 . . . . 0.0 110.423 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.82 -40.94 18.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.252 -0.905 . . . . 0.0 110.875 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -108.04 -55.78 2.32 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.253 -0.904 . . . . 0.0 110.419 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.08 18.72 1.66 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.139 -1.185 . . . . 0.0 110.139 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.483 HG23 ' HD2' ' B' ' 37' ' ' PRO . 80.8 mt -91.38 143.12 27.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.13 -1.217 . . . . 0.0 109.944 179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.483 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.8 Cg_endo -69.98 133.73 25.85 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 O-C-N 123.542 1.285 . . . . 0.0 110.492 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.81 -26.69 83.52 Favored 'Trans proline' 0 C--N 1.313 -1.321 0 O-C-N 123.618 1.325 . . . . 0.0 110.949 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -68.76 -24.25 64.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.357 -0.839 . . . . 0.0 109.968 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.432 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 28.8 mm-40 -101.43 0.59 37.13 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.288 -0.882 . . . . 0.0 110.441 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -94.38 140.25 30.05 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.14 -0.975 . . . . 0.0 110.447 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -130.14 128.43 41.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.453 -0.779 . . . . 0.0 109.797 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.905 ' HB3' HD12 ' B' ' 50' ' ' LEU . 32.5 mt -104.68 118.97 37.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.322 -0.861 . . . . 0.0 110.522 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.653 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.6 mp -121.36 135.98 59.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.506 -0.746 . . . . 0.0 109.922 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -140.83 151.2 44.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.468 -0.77 . . . . 0.0 109.708 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.37 28.27 0.45 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.511 -0.743 . . . . 0.0 111.195 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.54 1.44 76.64 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.01 137.67 48.36 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.07 -1.253 . . . . 0.0 110.175 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -78.33 139.13 38.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.258 -0.902 . . . . 0.0 109.998 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.905 HD12 ' HB3' ' B' ' 43' ' ' LEU . 55.1 mt -83.89 143.45 29.87 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.333 -0.855 . . . . 0.0 110.348 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.62 126.52 38.83 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.394 -0.816 . . . . 0.0 110.505 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.463 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.8 p30 -48.69 -29.73 4.75 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.444 -0.785 . . . . 0.0 111.132 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -6.15 88.69 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -99.47 158.6 15.62 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.025 -1.279 . . . . 0.0 110.388 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.5 p -102.06 164.12 11.88 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.438 -0.789 . . . . 0.0 110.288 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.61 ' HA ' HD12 ' B' ' 61' ' ' ILE . 92.9 mt -53.86 -45.7 71.04 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.341 -0.849 . . . . 0.0 110.751 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 55.4 p -56.58 -34.17 66.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.303 -0.873 . . . . 0.0 111.198 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -59.52 -27.65 66.36 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.094 -1.004 . . . . 0.0 110.374 -179.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.475 ' CG ' HD22 ' B' ' 50' ' ' LEU . 70.5 m-85 -101.12 27.02 6.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.857 . . . . 0.0 109.983 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.92 32.35 7.28 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.497 -0.752 . . . . 0.0 110.797 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.61 HD12 ' HA ' ' B' ' 56' ' ' LEU . 97.7 mt -81.56 108.91 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.286 -0.884 . . . . 0.0 109.869 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -105.64 173.67 6.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.374 -0.829 . . . . 0.0 110.346 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.4 ptmt -46.62 152.1 0.5 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.59 -0.694 . . . . 0.0 111.17 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.3 mm-40 62.84 15.47 8.26 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.792 -0.568 . . . . 0.0 110.841 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.64 139.17 49.17 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 11.4 m -107.37 111.05 23.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.216 -0.927 . . . . 0.0 110.03 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.444 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mp -102.29 164.0 11.92 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.28 -0.888 . . . . 0.0 110.022 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -108.88 130.7 55.43 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.243 -0.91 . . . . 0.0 109.996 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 tp -107.19 133.67 51.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.288 -0.883 . . . . 0.0 110.286 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.687 HG11 ' HB3' ' A' ' 21' ' ' GLU . 27.7 t -124.87 151.59 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.405 -0.809 . . . . 0.0 109.958 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.28 91.46 6.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.319 -0.863 . . . . 0.0 110.274 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -73.38 83.39 1.44 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.376 -0.828 . . . . 0.0 110.18 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 5.0 mt -88.54 159.18 18.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 110.148 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 34.3 mmm-85 51.67 55.5 9.27 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.377 -0.827 . . . . 0.0 110.385 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -152.35 -49.56 0.02 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.033 -1.426 . . . . 0.0 109.559 -179.921 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 20.2 p80 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.183 0.516 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mmm -76.93 -178.69 5.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.387 -0.821 . . . . 0.0 110.134 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.651 ' HA ' ' HB2' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -112.15 24.51 12.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.389 -0.819 . . . . 0.0 109.621 179.547 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.89 -82.19 0.86 Allowed Glycine 0 N--CA 1.487 2.078 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.5 tp -102.8 -32.24 9.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.359 -1.083 . . . . 0.0 110.182 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -94.17 82.14 0.97 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.651 ' HB2' ' HA ' ' A' ' 3' ' ' LEU . . . -167.11 110.02 0.69 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.428 -1.042 . . . . 0.0 110.188 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.0 m 52.17 25.49 3.33 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.31 -0.869 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -101.98 -18.23 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.317 -0.864 . . . . 0.0 110.273 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.4 62.36 1.11 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.309 -0.869 . . . . 0.0 110.131 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.22 92.86 3.88 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.223 -0.923 . . . . 0.0 110.096 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -154.66 -73.34 0.12 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.377 -0.827 . . . . 0.0 110.279 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -129.76 30.85 3.49 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.706 -1.358 . . . . 0.0 109.706 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.435 HG13 ' N ' ' A' ' 15' ' ' ASP . 12.3 p -125.14 -36.27 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.278 -1.13 . . . . 0.0 110.321 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.435 ' N ' HG13 ' A' ' 14' ' ' VAL . 2.9 m-20 -124.22 144.1 44.59 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.296 -0.878 . . . . 0.0 110.147 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 -12.9 29.97 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.696 1.366 . . . . 0.0 110.795 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.5 m -72.65 -7.93 52.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.653 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -86.41 -21.2 27.27 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.47 120.57 0.61 Allowed Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.281 -0.887 . . . . 0.0 109.765 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.31 -15.63 38.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 123.914 1.481 . . . . 0.0 110.129 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.638 ' HB3' HG11 ' B' ' 70' ' ' VAL . 13.8 mt-10 -75.52 -31.74 60.25 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.803 . . . . 0.0 109.398 179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.423 ' HA ' HD13 ' A' ' 22' ' ' LEU . 4.4 mm? -83.76 -29.4 27.47 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.601 -0.687 . . . . 0.0 109.361 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.69 -37.4 67.87 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.505 -0.747 . . . . 0.0 109.445 179.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.743 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.2 mm? -78.96 -33.69 45.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.51 -0.744 . . . . 0.0 109.503 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.501 ' HB1' HG21 ' B' ' 44' ' ' ILE . . . -68.74 -35.23 76.84 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.42 -0.8 . . . . 0.0 109.841 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -78.12 -22.67 48.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.452 -0.78 . . . . 0.0 110.088 179.795 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.16 -27.25 28.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.332 -0.855 . . . . 0.0 109.45 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.743 HG23 ' O ' ' A' ' 24' ' ' LEU . 68.5 t -82.4 -45.76 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.52 -0.737 . . . . 0.0 109.795 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -65.75 -41.36 92.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.336 -0.853 . . . . 0.0 110.022 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 tpp -64.17 -48.88 74.25 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.447 -0.783 . . . . 0.0 110.044 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -61.86 -40.09 94.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.449 -0.782 . . . . 0.0 110.101 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -62.6 -51.34 67.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.388 -0.82 . . . . 0.0 110.058 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -30.11 70.97 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.305 -0.872 . . . . 0.0 109.953 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.93 -44.46 85.07 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.354 -0.841 . . . . 0.0 109.977 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -61.74 -36.55 81.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.356 -0.84 . . . . 0.0 110.055 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -42.6 32.14 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.36 -0.838 . . . . 0.0 109.865 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.676 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 35.3 mm-40 -69.14 -29.71 67.81 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.43 -0.794 . . . . 0.0 110.035 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -83.96 -57.13 3.32 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.487 -0.758 . . . . 0.0 109.519 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -52.69 -33.37 47.15 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.515 -0.741 . . . . 0.0 109.217 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.87 -34.23 24.64 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.577 -0.702 . . . . 0.0 109.14 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.676 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.54 -51.51 65.13 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.443 -0.786 . . . . 0.0 109.659 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.42 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 10.3 ptt180 -64.5 -32.47 74.11 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.342 -0.849 . . . . 0.0 109.673 179.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.77 -42.39 68.19 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.407 -0.808 . . . . 0.0 109.135 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.6 -28.54 45.77 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.42 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -63.2 -29.35 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.535 -0.728 . . . . 0.0 109.636 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.12 -41.77 15.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.99 -33.05 74.92 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.298 -0.876 . . . . 0.0 110.032 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.5 t -77.96 -34.22 51.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.405 -0.809 . . . . 0.0 110.179 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.24 68.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.167 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.24 -25.49 51.64 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.393 -0.817 . . . . 0.0 110.204 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 93.79 5.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.258 -0.902 . . . . 0.0 110.241 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.52 27.06 4.68 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.25 -0.906 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -103.32 -44.44 1.71 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.2 pt -109.38 38.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.334 -1.098 . . . . 0.0 110.179 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.0 -42.9 13.6 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.253 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.2 p -90.04 57.3 3.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.193 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.8 t -166.15 145.74 6.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.352 -0.843 . . . . 0.0 110.239 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.46 44.2 0.21 Allowed Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.1 p -130.53 74.92 1.62 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.375 -1.073 . . . . 0.0 110.204 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -87.01 61.38 6.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.269 -0.895 . . . . 0.0 110.178 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.78 -40.47 95.31 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.324 -0.86 . . . . 0.0 110.199 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.99 71.73 3.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.416 -0.803 . . . . 0.0 110.148 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -76.81 -55.55 5.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.388 -0.82 . . . . 0.0 110.226 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -74.6 -28.13 60.77 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.183 -0.948 . . . . 0.0 109.161 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.09 -43.93 97.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.931 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.29 -29.2 69.94 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.1 tt -75.17 -43.46 52.1 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.482 -0.762 . . . . 0.0 109.891 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.423 -0.798 . . . . 0.0 110.482 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -39.87 61.48 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.144 -0.972 . . . . 0.0 110.671 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.7 m -69.43 -41.31 76.51 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.299 -0.876 . . . . 0.0 110.453 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.2 tp -82.18 -16.4 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.114 -0.991 . . . . 0.0 110.134 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.1 p -74.61 -33.74 62.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.3 -0.875 . . . . 0.0 109.748 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -27.71 23.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.469 -0.77 . . . . 0.0 109.93 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.6 -45.19 11.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.338 -0.851 . . . . 0.0 110.207 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -34.03 69.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.33 -0.856 . . . . 0.0 110.127 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -92.29 47.39 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.41 -0.806 . . . . 0.0 110.172 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.63 -36.01 1.48 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.99 113.31 25.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.317 -1.108 . . . . 0.0 110.273 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.9 m -153.78 27.47 0.49 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.436 -0.79 . . . . 0.0 110.219 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.45 28.01 16.85 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.02 146.95 1.46 Allowed Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.266 -1.137 . . . . 0.0 109.005 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.07 61.27 3.19 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.47 1.247 . . . . 0.0 110.31 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -72.04 89.18 1.11 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.532 -0.73 . . . . 0.0 110.246 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 84' ' ' LEU . 2.3 mm? -62.42 -28.54 69.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.422 -0.799 . . . . 0.0 110.142 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 42.6 m -70.08 -20.94 63.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.416 -0.802 . . . . 0.0 110.39 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -108.85 9.48 26.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.239 -0.913 . . . . 0.0 110.413 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 30.3 mtp -107.23 122.27 46.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.216 -0.927 . . . . 0.0 110.038 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.1 p -77.31 -165.05 0.53 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.465 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.572 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.9 pt-20 -67.14 -31.29 71.63 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.543 -0.723 . . . . 0.0 109.175 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.455 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.9 OUTLIER -85.48 -40.75 16.03 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -42.56 99.75 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -69.8 -35.92 75.24 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 178.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.572 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -62.84 -39.76 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 178.798 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.67 72.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.541 -0.724 . . . . 0.0 109.802 179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.21 -52.7 7.06 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.481 -0.762 . . . . 0.0 110.09 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.0 -33.09 74.94 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.4 -0.812 . . . . 0.0 110.39 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.2 ttm -80.2 -21.52 42.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.874 . . . . 0.0 109.824 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -73.69 -29.65 62.41 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.422 -0.799 . . . . 0.0 110.071 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.8 -28.59 21.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.464 -0.773 . . . . 0.0 110.184 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.78 -31.65 61.82 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.328 -0.858 . . . . 0.0 110.155 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.42 14.28 17.08 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.436 -0.79 . . . . 0.0 110.41 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.62 -25.98 50.22 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.209 -0.932 . . . . 0.0 110.17 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 117.84 38.37 0.83 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -77.06 65.68 2.74 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.36 -1.082 . . . . 0.0 110.198 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.22 -38.22 43.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.151 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -162.55 55.37 0.22 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.455 -0.778 . . . . 0.0 110.065 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.34 85.72 0.71 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -151.39 96.5 2.29 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.373 -1.074 . . . . 0.0 110.226 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.55 44.31 0.08 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.341 -0.85 . . . . 0.0 110.161 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -124.37 53.91 1.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.378 -0.826 . . . . 0.0 110.179 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.9 t -132.66 15.48 4.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.301 -0.875 . . . . 0.0 110.473 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.182 179.959 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ptt? . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.26 0.552 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . 0.443 ' HG2' HG22 ' B' ' 14' ' ' THR . 0.4 OUTLIER -97.24 145.38 26.12 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.502 -0.749 . . . . 0.0 109.903 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 12.7 pt -137.65 159.47 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.344 -0.848 . . . . 0.0 110.17 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -111.85 142.82 43.75 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.582 -0.699 . . . . 0.0 110.754 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -127.76 118.16 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.476 -0.765 . . . . 0.0 109.503 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 30.2 mttt -100.25 135.19 42.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.372 -0.83 . . . . 0.0 110.607 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 60.3 p -96.04 170.04 9.56 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.454 -0.779 . . . . 0.0 110.189 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.693 HD11 HG13 ' B' ' 70' ' ' VAL . 8.3 mt -61.82 -9.27 6.23 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.459 -0.776 . . . . 0.0 111.203 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 80.9 p -95.27 -13.34 24.94 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.081 -1.012 . . . . 0.0 110.564 -179.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.96 6.16 40.26 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.238 -1.145 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 56.7 tttt -84.61 128.56 34.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.113 -1.228 . . . . 0.0 110.049 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 4.8 m -113.23 125.21 54.07 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.303 -0.873 . . . . 0.0 110.08 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.4 mt -109.12 135.13 48.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.439 -0.788 . . . . 0.0 110.522 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.443 HG22 ' HG2' ' B' ' 2' ' ' GLN . 3.1 m -102.43 118.0 35.93 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.516 -0.74 . . . . 0.0 109.26 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -123.38 166.45 15.31 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.156 -0.965 . . . . 0.0 110.821 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.5 115.11 29.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.441 -0.787 . . . . 0.0 109.528 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.441 HG12 ' CD ' ' B' ' 29' ' ' LYS . 21.5 m -140.51 170.26 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.282 -0.886 . . . . 0.0 110.823 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -112.7 164.62 14.95 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.586 -0.696 . . . . 0.0 109.185 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -70.94 -25.51 23.04 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.569 1.3 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -84.36 -3.93 58.58 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.444 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -71.31 143.6 50.24 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.559 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.6 p -83.21 156.66 23.06 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.547 -0.72 . . . . 0.0 110.446 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 31.4 mm -59.67 -34.77 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.383 -0.823 . . . . 0.0 109.616 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.74 -36.92 82.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.34 -0.85 . . . . 0.0 109.33 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -70.2 -32.21 70.02 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.465 -0.772 . . . . 0.0 109.353 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 67.8 t -70.36 -39.2 76.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.451 -0.78 . . . . 0.0 109.049 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -63.14 -43.78 97.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.103 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.51 -33.05 73.13 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.463 -0.773 . . . . 0.0 109.469 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.441 ' CD ' HG12 ' B' ' 17' ' ' VAL . 19.6 mttm -68.07 -40.26 82.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.495 -0.753 . . . . 0.0 109.543 179.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.423 HD13 HD22 ' B' ' 69' ' ' LEU . 18.0 mt -67.1 -37.14 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.586 -0.845 . . . . 0.0 109.03 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -60.83 -52.72 63.86 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.474 -0.767 . . . . 0.0 109.644 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.09 -27.46 63.7 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.341 -0.849 . . . . 0.0 110.712 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -84.0 -39.93 19.07 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.198 -0.939 . . . . 0.0 111.037 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -108.15 -54.19 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.278 -0.889 . . . . 0.0 110.512 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.81 16.64 2.19 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.264 -1.135 . . . . 0.0 110.264 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.495 HG23 ' HD2' ' B' ' 37' ' ' PRO . 93.5 mt -91.2 143.51 28.48 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.077 -1.249 . . . . 0.0 109.778 179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.495 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -69.49 133.88 27.17 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.66 1.347 . . . . 0.0 110.556 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.83 -26.43 83.05 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.741 1.39 . . . . 0.0 110.81 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.78 -25.65 64.81 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.341 -0.85 . . . . 0.0 109.902 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.448 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 58.8 mm-40 -101.26 4.36 41.7 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.35 -0.844 . . . . 0.0 110.464 179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -94.22 139.32 31.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.238 -0.914 . . . . 0.0 110.468 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -130.17 126.4 37.35 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.473 -0.767 . . . . 0.0 109.783 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.769 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.7 mt -104.64 117.91 35.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.251 -0.905 . . . . 0.0 110.376 -179.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.769 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -121.35 138.06 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.513 -0.742 . . . . 0.0 109.92 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.56 ' HB2' HD23 ' B' ' 67' ' ' LEU . 66.8 t80 -140.7 147.88 39.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.567 -0.708 . . . . 0.0 109.753 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.42 28.8 0.51 Allowed 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.416 -0.803 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.8 3.75 87.69 Favored Glycine 0 N--CA 1.495 2.568 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.85 133.69 53.15 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.083 -1.245 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -78.49 134.3 37.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.237 -0.914 . . . . 0.0 110.064 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.881 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.9 mt -84.27 140.31 31.74 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.385 -0.822 . . . . 0.0 110.28 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -93.67 130.49 39.59 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.406 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.502 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.2 m-20 -48.43 -26.75 2.25 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.433 -0.792 . . . . 0.0 111.202 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.96 -8.05 86.33 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.702 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.479 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.34 159.04 15.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.01 -1.288 . . . . 0.0 110.432 -179.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.1 p -102.08 162.98 12.49 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.396 -0.815 . . . . 0.0 110.182 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.414 ' HA ' HD12 ' B' ' 61' ' ' ILE . 82.0 mt -53.45 -43.98 68.53 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.295 -0.878 . . . . 0.0 110.669 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.9 -34.72 68.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.413 -0.804 . . . . 0.0 111.131 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.5 -26.96 65.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.11 -0.994 . . . . 0.0 110.394 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.881 ' CD2' HD22 ' B' ' 50' ' ' LEU . 53.2 m-85 -101.15 26.21 7.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.285 -0.884 . . . . 0.0 110.053 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m120 50.63 31.06 5.34 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.541 -0.724 . . . . 0.0 110.728 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.5 mt -81.41 114.53 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.86 . . . . 0.0 109.784 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -105.55 167.86 9.47 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.384 -0.823 . . . . 0.0 110.219 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.9 pttt -46.54 153.13 0.39 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.479 -0.763 . . . . 0.0 111.041 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 21.0 mt-10 63.4 14.01 7.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.766 -0.584 . . . . 0.0 110.818 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.83 144.62 49.05 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.157 -0.964 . . . . 0.0 110.225 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 25.0 m -107.51 110.9 22.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.331 -0.856 . . . . 0.0 109.818 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.56 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.7 mt -102.38 165.03 11.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.252 -0.905 . . . . 0.0 110.344 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.412 ' NE2' HG12 ' A' ' 28' ' ' VAL . 60.2 m80 -108.82 129.53 55.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.358 -0.839 . . . . 0.0 110.125 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.423 HD22 HD13 ' B' ' 30' ' ' ILE . 60.3 tp -107.34 131.24 54.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.317 -0.864 . . . . 0.0 110.239 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.693 HG13 HD11 ' B' ' 8' ' ' LEU . 47.1 t -124.89 154.3 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.423 -0.798 . . . . 0.0 110.18 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 39.0 mt -94.44 110.21 22.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.375 -0.828 . . . . 0.0 110.219 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.2 tmm_? -84.82 87.84 7.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.318 -0.864 . . . . 0.0 110.159 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 4.7 mt -97.12 129.93 44.46 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.18 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 4.0 ttm180 -162.12 83.24 0.57 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.411 -0.806 . . . . 0.0 110.155 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -113.33 67.47 0.25 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.374 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.97 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.446 ' O ' ' N ' ' A' ' 3' ' ' LEU . 47.4 t-80 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.142 0.496 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.578 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 66.18 -64.67 0.21 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.571 -0.706 . . . . 0.0 110.657 179.995 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.578 ' CB ' ' O ' ' A' ' 2' ' ' MET . 0.9 OUTLIER 81.8 34.96 0.08 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.875 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -75.11 -30.98 58.21 Favored Glycine 0 N--CA 1.481 1.688 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.4 tp -75.7 -39.35 57.56 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -1.1 . . . . 0.0 110.239 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . -77.02 -146.75 2.32 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.439 ' O ' ' N ' ' A' ' 9' ' ' ASP . . . 56.21 102.32 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.363 -1.08 . . . . 0.0 110.6 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m 67.0 -64.0 0.26 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.547 -0.721 . . . . 0.0 110.581 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.439 ' N ' ' O ' ' A' ' 7' ' ' ALA . 1.1 m-20 -51.81 -27.64 13.05 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.294 -0.879 . . . . 0.0 110.442 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.401 ' CG ' ' O ' ' A' ' 9' ' ' ASP . 28.6 m-85 -156.51 105.04 2.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.452 -0.78 . . . . 0.0 110.153 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -157.73 34.16 0.26 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.307 -0.871 . . . . 0.0 110.295 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -132.73 -53.04 0.93 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.349 -0.845 . . . . 0.0 110.179 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -114.42 29.2 7.74 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.4 HG13 ' N ' ' A' ' 15' ' ' ASP . 11.3 p -125.51 -34.09 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -1.038 . . . . 0.0 110.402 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.4 ' N ' HG13 ' A' ' 14' ' ' VAL . 74.1 m-20 -129.48 126.74 22.92 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.304 -0.872 . . . . 0.0 110.15 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -70.69 -10.7 28.35 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.599 1.315 . . . . 0.0 110.859 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 52.7 p -69.87 -11.25 60.72 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.195 -0.941 . . . . 0.0 110.457 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.31 -26.62 26.45 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.227 -0.92 . . . . 0.0 110.276 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -168.31 117.09 0.63 Allowed Pre-proline 0 N--CA 1.489 1.519 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.39 -14.59 34.23 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 124.013 1.533 . . . . 0.0 110.094 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.403 ' HB3' ' CG1' ' B' ' 70' ' ' VAL . 0.1 OUTLIER -74.39 -31.67 62.44 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.455 -0.778 . . . . 0.0 109.358 179.433 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.11 -30.87 25.61 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.62 -35.57 77.49 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.152 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.673 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -77.78 -34.58 52.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.533 -0.73 . . . . 0.0 109.492 179.34 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.24 -31.02 72.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.472 -0.767 . . . . 0.0 109.969 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.6 -25.56 33.09 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.377 -0.827 . . . . 0.0 110.125 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.4 ttt-85 -83.78 -28.98 27.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.605 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.673 HG23 ' O ' ' A' ' 24' ' ' LEU . 64.3 t -80.84 -28.36 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.53 -0.731 . . . . 0.0 109.919 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -78.43 -45.2 22.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.475 -0.766 . . . . 0.0 110.128 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.6 tpt -64.81 -39.19 93.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.401 -0.812 . . . . 0.0 110.043 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -68.83 -32.23 71.77 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.452 -0.78 . . . . 0.0 110.228 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -69.25 -48.24 62.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.346 -0.846 . . . . 0.0 110.115 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.71 -29.71 66.89 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.348 -0.845 . . . . 0.0 110.164 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.93 -44.65 63.28 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.854 . . . . 0.0 110.272 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.59 -29.13 66.2 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.332 -0.855 . . . . 0.0 110.356 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 15.5 mtt-85 -81.02 -47.25 13.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.324 -0.86 . . . . 0.0 110.134 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.8 OUTLIER -75.1 -19.91 59.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.324 -0.86 . . . . 0.0 110.194 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -83.76 -58.89 2.61 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.318 -0.864 . . . . 0.0 109.691 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -52.29 -33.81 43.87 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.428 -0.795 . . . . 0.0 109.294 179.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -81.35 -35.17 31.22 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.85 -52.76 58.6 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.537 -0.727 . . . . 0.0 109.562 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.407 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 14.6 ptt85 -68.59 -30.63 69.42 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.389 -0.819 . . . . 0.0 109.65 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.2 mmm180 -53.13 -40.63 64.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.431 -0.793 . . . . 0.0 109.396 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.58 -27.75 37.35 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.547 -0.721 . . . . 0.0 109.093 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -65.82 -29.93 70.48 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.557 -0.715 . . . . 0.0 109.799 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.26 -50.04 6.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.5 67.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.38 -0.825 . . . . 0.0 110.07 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.3 p -88.17 -45.76 9.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.393 -0.817 . . . . 0.0 110.146 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.84 -30.31 71.4 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.444 -0.785 . . . . 0.0 110.233 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.59 -32.58 72.69 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.38 -0.825 . . . . 0.0 110.104 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -114.44 47.12 1.27 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.403 -0.81 . . . . 0.0 110.189 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -168.23 -53.71 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.307 -0.871 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.65 -32.43 57.38 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.641 HG23 ' O ' ' A' ' 54' ' ' ILE . 6.1 tp -123.04 83.57 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -1.11 . . . . 0.0 110.248 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -116.6 90.25 3.29 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.243 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.569 HG23 ' O ' ' A' ' 56' ' ' THR . 8.5 t -64.78 119.11 10.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.389 -0.819 . . . . 0.0 110.233 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 57' ' ' THR . 28.7 m -109.2 50.14 0.79 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.351 -0.843 . . . . 0.0 110.274 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -149.1 -128.83 1.72 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.517 HG23 ' O ' ' A' ' 59' ' ' THR . 6.0 t -161.36 70.02 0.35 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -1.061 . . . . 0.0 110.176 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -144.13 61.96 1.35 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.356 -0.84 . . . . 0.0 110.236 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -148.21 -54.92 0.2 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.171 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.591 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -109.79 75.2 0.93 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.431 -0.793 . . . . 0.0 110.116 -180.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -75.47 -47.99 24.65 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.27 -0.894 . . . . 0.0 110.364 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.18 -28.89 61.51 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.243 -0.91 . . . . 0.0 109.075 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.591 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -61.68 -44.47 96.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.939 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.4 tp -65.08 -28.35 69.4 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 178.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.568 ' C ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -73.45 -48.35 34.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.535 -0.728 . . . . 0.0 109.563 179.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.63 -52.95 7.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.859 . . . . 0.0 110.545 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 tpt -51.73 -38.78 56.77 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.232 -0.917 . . . . 0.0 110.824 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.3 m -71.11 -40.65 71.33 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.264 -0.898 . . . . 0.0 110.396 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 tp -83.65 -13.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.973 . . . . 0.0 110.226 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 m -76.28 -48.43 20.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.293 -0.88 . . . . 0.0 109.784 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -25.41 47.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 110.064 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -81.72 -47.69 12.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.831 . . . . 0.0 110.223 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.29 -44.19 97.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.286 -0.883 . . . . 0.0 110.155 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -83.67 90.32 7.27 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.458 -0.776 . . . . 0.0 110.153 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.53 -41.4 0.04 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.539 -1.425 . . . . 0.0 109.539 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.93 88.56 7.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.384 -1.068 . . . . 0.0 110.198 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -153.12 90.34 1.43 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.423 -0.798 . . . . 0.0 110.136 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.411 ' H ' HD23 ' A' ' 81' ' ' LEU . . . -135.64 47.92 0.95 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.411 HD23 ' H ' ' A' ' 80' ' ' GLY . 0.5 OUTLIER -173.18 149.16 1.69 Allowed Pre-proline 0 N--CA 1.488 1.45 0 O-C-N 121.37 -1.076 . . . . 0.0 108.911 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -72.12 63.38 3.39 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 123.51 1.269 . . . . 0.0 110.535 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 46.0 p-10 -71.1 70.21 0.53 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.183 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.13 -29.33 61.76 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.117 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -64.56 -19.54 65.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.358 -0.839 . . . . 0.0 110.419 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 41.4 t -102.49 -19.05 15.05 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.271 -0.893 . . . . 0.0 110.606 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.411 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 9.6 mtp -88.98 129.79 35.58 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.191 -0.943 . . . . 0.0 110.301 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 75.4 p -79.48 -163.75 0.55 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.449 -0.782 . . . . 0.0 110.496 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.545 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -67.24 -31.83 72.44 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.477 -0.764 . . . . 0.0 109.248 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 27.3 mt-10 -85.44 -40.61 16.22 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -63.89 -42.26 97.52 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HG3' ' HB3' ' A' ' 87' ' ' MET . 94.0 mt-30 -69.1 -35.39 76.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.545 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.31 -36.83 76.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.87 -29.76 69.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.525 -0.734 . . . . 0.0 109.616 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -83.82 -38.51 21.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.466 -0.772 . . . . 0.0 110.057 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -79.57 -28.98 41.12 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.329 -0.857 . . . . 0.0 110.469 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.462 ' O ' HD23 ' A' ' 101' ' ' LEU . 1.7 tmt? -83.96 -31.83 25.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.3 -0.875 . . . . 0.0 109.73 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -73.03 -29.37 62.94 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.505 -0.747 . . . . 0.0 110.008 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 33.5 mtp -90.36 -21.26 22.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.426 -0.796 . . . . 0.0 110.269 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.43 -57.53 3.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.213 -0.929 . . . . 0.0 110.373 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.582 HD12 ' N ' ' A' ' 102' ' ' GLN . 4.3 pp -61.74 -28.16 69.23 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.278 -0.889 . . . . 0.0 110.272 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . 0.582 ' N ' HD12 ' A' ' 101' ' ' LEU . 51.2 tt0 -61.69 -55.37 31.13 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.404 -0.81 . . . . 0.0 110.171 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 88.78 132.96 4.46 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -150.89 70.51 1.0 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.374 -1.074 . . . . 0.0 110.157 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -116.43 -57.06 2.24 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.342 -0.849 . . . . 0.0 110.128 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -115.61 69.49 0.73 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.428 -0.795 . . . . 0.0 110.16 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -83.8 124.28 6.55 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.73 57.9 1.38 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.333 -1.098 . . . . 0.0 110.258 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.97 -66.09 0.95 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.36 -0.838 . . . . 0.0 110.186 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 51.9 56.86 7.18 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.405 -0.81 . . . . 0.0 110.433 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.4 m -138.77 64.81 1.47 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 110.169 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.262 179.971 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.4 ttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.303 0.573 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -112.96 140.19 47.97 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.374 -0.829 . . . . 0.0 109.606 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.504 HD13 HG21 ' B' ' 17' ' ' VAL . 43.2 pt -137.72 157.15 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.212 -0.93 . . . . 0.0 110.535 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -111.89 144.89 40.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.598 -0.689 . . . . 0.0 110.546 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 68.4 t -128.13 122.38 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.342 -0.849 . . . . 0.0 109.603 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.469 ' HG3' HG23 ' B' ' 12' ' ' THR . 12.0 mttt -100.16 131.98 45.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.689 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.4 p -95.79 175.71 6.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.431 -0.793 . . . . 0.0 109.921 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 22.1 mt -61.57 -12.77 16.96 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.309 -0.869 . . . . 0.0 111.17 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.2 p -95.73 14.5 22.95 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.007 -1.058 . . . . 0.0 110.925 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.84 8.34 68.1 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.432 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 24.5 tttt -84.79 134.02 34.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.066 -1.256 . . . . 0.0 109.913 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.469 HG23 ' HG3' ' B' ' 6' ' ' LYS . 5.3 m -113.26 130.28 56.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -0.881 . . . . 0.0 110.318 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.1 mt -109.15 141.89 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.401 -0.812 . . . . 0.0 110.239 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 8.5 m -101.84 121.94 43.05 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.441 -0.787 . . . . 0.0 109.504 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.443 HD23 ' HE2' ' B' ' 33' ' ' LYS . 4.6 mt -123.27 156.27 35.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.16 -0.963 . . . . 0.0 110.831 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.29 113.95 27.79 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.422 -0.798 . . . . 0.0 109.422 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.691 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.2 m -139.9 178.46 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.309 -0.869 . . . . 0.0 110.856 -179.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.609 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.8 OUTLIER -113.01 166.14 11.7 Favored Pre-proline 0 N--CA 1.489 1.492 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -72.27 -28.86 14.81 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.469 1.247 . . . . 0.0 110.277 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.1 p -84.44 -0.68 53.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.201 -0.937 . . . . 0.0 110.63 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -71.21 142.71 50.61 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.129 -0.982 . . . . 0.0 110.455 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.38 159.51 21.81 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.537 -0.727 . . . . 0.0 110.498 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.861 HG23 HD12 ' B' ' 43' ' ' LEU . 44.1 mm -59.71 -38.03 73.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.363 -0.836 . . . . 0.0 109.565 179.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.61 -36.88 74.74 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.385 -0.822 . . . . 0.0 109.425 179.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -70.06 -31.17 68.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.495 -0.753 . . . . 0.0 109.208 179.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 22' ' ' THR . 58.2 t -70.24 -39.89 77.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 119.839 -0.745 . . . . 0.0 109.134 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -63.26 -43.05 99.06 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.502 -0.749 . . . . 0.0 109.178 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.9 76.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.502 -0.749 . . . . 0.0 109.49 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.691 ' CD ' HG12 ' B' ' 17' ' ' VAL . 30.4 mttm -68.12 -38.32 82.09 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.501 -0.749 . . . . 0.0 109.491 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 7.7 mt -67.19 -39.73 83.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.415 -0.803 . . . . 0.0 109.111 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' B' ' 35' ' ' GLY . 13.9 tt0 -60.61 -47.86 84.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.301 -0.875 . . . . 0.0 109.299 178.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -58.01 -27.76 63.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.407 -0.808 . . . . 0.0 110.241 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.443 ' HE2' HD23 ' B' ' 15' ' ' LEU . 2.9 mmtm -84.27 -41.26 17.06 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.399 -0.813 . . . . 0.0 110.874 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -107.76 -55.79 2.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.248 -0.907 . . . . 0.0 110.365 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 126.8 21.27 1.77 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.524 HG23 ' HD2' ' B' ' 37' ' ' PRO . 56.8 mt -91.65 144.4 29.44 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.197 -1.178 . . . . 0.0 109.976 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.524 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.1 Cg_endo -68.51 131.83 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.536 1.282 . . . . 0.0 110.622 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.96 -24.61 79.87 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.653 1.344 . . . . 0.0 110.714 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.61 -25.4 64.84 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.374 -0.829 . . . . 0.0 109.731 179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.429 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 4.4 mt-30 -101.33 0.1 36.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.49 -0.756 . . . . 0.0 110.425 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -94.44 137.22 33.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.201 -0.937 . . . . 0.0 110.475 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -130.22 134.69 47.44 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.454 -0.779 . . . . 0.0 109.765 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.861 HD12 HG23 ' B' ' 23' ' ' ILE . 18.0 mt -104.67 116.59 32.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.217 -0.927 . . . . 0.0 110.333 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.788 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.2 mp -121.21 135.14 62.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.463 -0.773 . . . . 0.0 109.831 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.526 ' HB2' HD23 ' B' ' 67' ' ' LEU . 25.8 t80 -140.69 145.98 37.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.338 -0.851 . . . . 0.0 109.767 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.66 28.93 0.59 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.515 -0.741 . . . . 0.0 110.932 -179.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.56 5.1 88.02 Favored Glycine 0 N--CA 1.494 2.524 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -111.03 128.71 55.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.166 -1.197 . . . . 0.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.46 132.48 37.3 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.332 -0.855 . . . . 0.0 109.589 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.845 HD22 ' CD2' ' B' ' 59' ' ' TYR . 48.9 mt -83.74 142.96 30.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.223 -0.923 . . . . 0.0 110.274 -179.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -93.5 133.12 37.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.486 -0.759 . . . . 0.0 110.442 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.478 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 65.9 m-20 -48.54 -28.18 3.22 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.565 -0.709 . . . . 0.0 111.027 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -5.85 88.81 Favored Glycine 0 N--CA 1.493 2.473 0 C-N-CA 120.116 -1.04 . . . . 0.0 110.692 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.455 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 11.2 mmt180 -99.51 153.57 18.92 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.027 -1.278 . . . . 0.0 110.488 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 66.6 p -102.23 165.63 11.03 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.291 -0.881 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.609 HD12 ' O ' ' B' ' 18' ' ' GLU . 87.8 mt -53.6 -45.66 70.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.29 -0.881 . . . . 0.0 110.78 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -56.82 -38.39 72.54 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.432 -0.792 . . . . 0.0 110.958 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -59.68 -27.93 66.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.325 -0.86 . . . . 0.0 110.425 -179.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.845 ' CD2' HD22 ' B' ' 50' ' ' LEU . 40.8 m-85 -100.98 26.72 6.67 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 109.954 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 50.69 27.39 2.97 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.54 -0.725 . . . . 0.0 110.569 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.565 HG21 HD22 ' B' ' 56' ' ' LEU . 88.0 mt -81.37 109.46 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.377 -0.827 . . . . 0.0 109.79 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.54 172.11 6.97 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.426 -0.796 . . . . 0.0 110.164 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.44 152.73 0.42 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.547 -0.721 . . . . 0.0 111.084 -179.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 9.7 mm-40 63.0 16.55 9.37 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.81 -0.556 . . . . 0.0 110.595 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.63 145.66 48.82 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.302 -0.874 . . . . 0.0 110.008 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.3 m -107.91 108.05 19.04 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.526 HD23 ' HB2' ' B' ' 45' ' ' PHE . 10.3 mt -102.54 157.96 16.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.29 -0.881 . . . . 0.0 110.091 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -108.88 138.52 45.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.254 -0.904 . . . . 0.0 109.995 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 45.9 tp -106.95 133.16 52.02 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.349 -0.845 . . . . 0.0 110.276 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.403 ' CG1' ' HB3' ' A' ' 21' ' ' GLU . 61.5 t -125.01 158.14 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.438 -0.789 . . . . 0.0 110.405 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 12.5 mt -94.26 121.44 35.78 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.312 -0.867 . . . . 0.0 110.251 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.23 101.76 13.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.351 -0.843 . . . . 0.0 110.164 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 mp -104.86 178.19 4.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.342 -0.849 . . . . 0.0 110.325 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 53.62 95.66 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.391 -0.818 . . . . 0.0 110.558 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -92.54 163.93 27.68 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 CA-C-O 118.037 -1.424 . . . . 0.0 109.578 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.2 t60 . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.15 0.5 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mtp -62.08 -177.17 0.11 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.825 . . . . 0.0 110.195 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -112.71 24.48 12.41 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.438 -0.789 . . . . 0.0 109.689 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.55 -102.19 0.09 OUTLIER Glycine 0 N--CA 1.488 2.165 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mt -128.26 -62.94 1.02 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.383 -1.069 . . . . 0.0 110.139 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -163.37 -164.87 19.48 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.6 32.97 5.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.332 -1.099 . . . . 0.0 110.17 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -146.75 21.69 1.28 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.422 -0.799 . . . . 0.0 110.326 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.96 -18.0 15.87 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.316 -0.865 . . . . 0.0 110.177 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 27.0 p90 -161.99 45.67 0.16 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.341 -0.849 . . . . 0.0 110.133 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.03 68.93 0.32 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.536 -0.727 . . . . 0.0 110.107 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 52.32 25.07 3.19 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.285 -0.884 . . . . 0.0 110.519 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -117.8 35.4 4.09 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.263 -1.535 . . . . 0.0 109.263 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.1 t -143.57 -64.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -1.071 . . . . 0.0 110.166 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.54 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.4 OUTLIER -166.36 -178.75 0.73 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.483 -0.761 . . . . 0.0 109.577 -179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.685 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 37.2 Cg_endo -61.33 78.27 0.08 OUTLIER 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.486 1.256 . . . . 0.0 111.028 -178.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.455 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 69.6 44.63 0.87 Allowed 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.7 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.49 25.25 0.07 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.27 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.605 ' HB3' HD12 ' A' ' 22' ' ' LEU . 0.7 OUTLIER -170.15 112.78 0.47 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.133 -0.979 . . . . 0.0 110.342 179.936 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.23 -14.37 28.52 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.932 1.49 . . . . 0.0 109.828 179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.46 ' HB3' HG13 ' B' ' 70' ' ' VAL . 46.7 mt-10 -75.75 -35.94 60.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.439 -0.788 . . . . 0.0 109.444 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 19' ' ' ASP . 3.6 mt -78.09 -30.23 49.47 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.082 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.685 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -70.14 -36.63 74.91 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.524 -0.735 . . . . 0.0 109.175 179.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.689 ' O ' HG23 ' A' ' 28' ' ' VAL . 29.7 tp -77.31 -30.41 54.1 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.631 -0.668 . . . . 0.0 109.362 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -38.44 91.15 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.321 -0.862 . . . . 0.0 109.729 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 68.2 tp -80.39 -22.13 41.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.466 -0.771 . . . . 0.0 110.194 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.02 -28.94 35.24 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.3 -0.875 . . . . 0.0 109.207 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 24' ' ' LEU . 94.2 t -79.69 -28.72 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 121.631 -0.668 . . . . 0.0 109.589 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.8 p -74.28 -43.37 57.17 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.536 -0.727 . . . . 0.0 110.01 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 2.9 mmt -68.6 -31.22 70.24 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.423 -0.798 . . . . 0.0 110.207 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.6 -33.45 64.61 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.344 -0.847 . . . . 0.0 110.104 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -69.9 -45.48 67.5 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.363 -0.835 . . . . 0.0 110.126 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -65.65 -36.13 82.79 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.4 -0.812 . . . . 0.0 110.268 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.48 -43.01 81.99 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.382 -0.824 . . . . 0.0 110.098 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -58.98 -41.86 88.6 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.285 -0.885 . . . . 0.0 110.323 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -78.35 -39.84 38.23 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.373 -0.829 . . . . 0.0 110.279 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.58 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 32.4 mt-30 -73.68 -24.18 59.93 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -77.24 -55.04 5.76 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 109.477 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -53.26 -32.17 47.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.344 -0.847 . . . . 0.0 109.073 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -87.11 -34.52 19.08 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.695 -0.628 . . . . 0.0 109.499 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.58 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -67.22 -50.95 58.86 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.361 -0.837 . . . . 0.0 110.017 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -66.8 -36.06 81.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.425 -0.797 . . . . 0.0 110.395 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -57.1 -37.81 72.47 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.342 -0.849 . . . . 0.0 110.133 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.84 -26.13 37.24 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.436 -0.79 . . . . 0.0 109.916 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.39 -29.29 59.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.398 -0.814 . . . . 0.0 109.989 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.32 -38.26 20.61 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.219 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.33 -33.07 74.9 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.345 -0.847 . . . . 0.0 110.158 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -80.04 -31.23 39.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.385 -0.822 . . . . 0.0 110.182 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.85 95.59 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.351 -0.843 . . . . 0.0 110.168 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.733 ' O ' HG22 ' A' ' 54' ' ' ILE . . . -76.24 -21.16 56.69 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.321 -0.862 . . . . 0.0 110.352 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -55.38 -24.37 29.47 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.285 -0.884 . . . . 0.0 110.522 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -109.74 -25.59 10.29 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.335 -0.853 . . . . 0.0 110.205 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.16 67.1 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.733 -1.347 . . . . 0.0 109.733 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.733 HG22 ' O ' ' A' ' 50' ' ' ALA . 13.8 tt -108.25 77.13 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.295 -1.12 . . . . 0.0 110.257 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -164.67 -51.05 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.229 -0.919 . . . . 0.0 110.239 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.3 p -139.89 52.35 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.375 -0.828 . . . . 0.0 110.263 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.7 p -124.91 -60.21 1.38 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.382 -0.824 . . . . 0.0 110.288 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -148.6 39.21 0.97 Allowed Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.3 p -80.76 76.44 7.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.269 -1.136 . . . . 0.0 110.269 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -91.53 55.79 2.86 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.257 -0.902 . . . . 0.0 110.174 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.98 -32.31 61.65 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.319 -0.863 . . . . 0.0 110.225 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.7 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.5 OUTLIER -100.89 73.27 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.43 -0.794 . . . . 0.0 110.088 -179.922 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.49 -38.02 74.29 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -75.1 -28.92 60.45 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.246 -0.909 . . . . 0.0 109.145 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.7 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -62.42 -43.92 97.66 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 119.685 -0.806 . . . . 0.0 108.869 179.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -28.62 69.44 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -75.69 -45.78 34.95 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.598 -0.688 . . . . 0.0 109.869 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.447 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.01 -53.51 6.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.484 -0.76 . . . . 0.0 110.487 -179.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -51.92 -40.37 60.64 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.139 -0.976 . . . . 0.0 110.643 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.2 m -69.43 -41.17 76.66 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.259 -0.9 . . . . 0.0 110.423 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.447 HG22 ' HA ' ' A' ' 68' ' ' LYS . 6.0 tp -85.38 -10.62 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.076 -1.015 . . . . 0.0 110.466 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.421 ' N ' ' O ' ' A' ' 68' ' ' LYS . 30.3 t -80.32 -36.27 34.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.717 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -89.25 -23.87 22.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.54 -0.725 . . . . 0.0 110.067 179.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -89.84 -40.71 12.26 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.344 -0.847 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.12 -33.41 26.31 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.303 -0.873 . . . . 0.0 110.181 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -118.97 45.7 2.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.303 -0.873 . . . . 0.0 110.245 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -119.18 -51.33 0.29 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 106.36 18.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.356 -1.084 . . . . 0.0 110.124 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.2 m -153.02 30.64 0.49 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.45 -0.781 . . . . 0.0 110.285 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.48 ' O ' HD12 ' A' ' 81' ' ' LEU . . . -96.93 36.19 4.03 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.516 -1.433 . . . . 0.0 109.516 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.48 HD12 ' O ' ' A' ' 80' ' ' GLY . 0.3 OUTLIER -161.47 142.58 8.46 Favored Pre-proline 0 C--N 1.307 -1.265 0 O-C-N 121.393 -1.063 . . . . 0.0 108.911 179.827 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.537 ' O ' HD12 ' A' ' 84' ' ' LEU . 47.3 Cg_endo -74.72 50.52 2.44 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 123.52 1.274 . . . . 0.0 110.441 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.65 98.82 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.921 . . . . 0.0 110.198 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.537 HD12 ' O ' ' A' ' 82' ' ' PRO . 0.2 OUTLIER -101.4 -24.79 14.13 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.316 -0.865 . . . . 0.0 110.262 179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.38 -28.04 57.98 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.394 -0.816 . . . . 0.0 110.292 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.99 -21.38 18.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.351 -0.843 . . . . 0.0 110.285 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 9.1 mtt -71.37 122.06 19.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.263 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.492 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 80.7 p -73.1 -162.32 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.47 -0.769 . . . . 0.0 110.367 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.543 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 3.9 pt-20 -69.49 -29.45 67.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.511 -0.743 . . . . 0.0 109.365 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.437 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 0.7 OUTLIER -84.7 -38.41 19.77 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.785 -0.821 . . . . 0.0 108.785 179.085 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.492 ' HB2' ' N ' ' A' ' 88' ' ' THR . 10.0 mm-40 -66.52 -43.77 84.29 Favored 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -66.6 -35.39 80.09 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 177.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.543 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.8 -35.74 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 178.703 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.2 -38.84 92.51 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.622 -0.674 . . . . 0.0 109.402 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -73.17 -44.89 59.23 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.508 -0.745 . . . . 0.0 109.95 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.77 82.16 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.414 -0.804 . . . . 0.0 110.019 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 20.5 mmt -79.32 -24.64 42.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.31 -0.869 . . . . 0.0 109.628 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -65.88 -44.39 85.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.46 -0.775 . . . . 0.0 109.991 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 41.4 mtp -76.18 -26.13 55.91 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.364 -0.835 . . . . 0.0 110.08 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 39.5 t -73.52 -29.04 62.22 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.406 -0.809 . . . . 0.0 110.086 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mp -87.86 7.34 31.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.32 -0.862 . . . . 0.0 110.466 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -68.15 -35.03 77.41 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.203 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 82.9 23.58 55.18 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -169.7 64.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.25 -1.147 . . . . 0.0 110.174 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -86.53 -38.42 17.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.352 -0.843 . . . . 0.0 110.144 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -88.23 -20.69 25.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.37 -0.831 . . . . 0.0 110.352 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.08 92.52 0.05 OUTLIER Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.66 66.84 1.25 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.405 -1.056 . . . . 0.0 110.05 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -164.83 115.49 1.16 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.283 -0.886 . . . . 0.0 110.216 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -128.02 91.83 3.34 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.326 -0.859 . . . . 0.0 110.259 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 56.8 p -130.76 -174.85 3.48 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.276 -0.89 . . . . 0.0 110.236 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.169 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.461 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.4 ttp . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.241 0.543 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -88.09 140.78 29.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.0 109.717 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.492 HD13 HG21 ' B' ' 17' ' ' VAL . 35.3 pt -137.37 157.65 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.257 -0.902 . . . . 0.0 110.259 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -111.8 144.31 41.31 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.654 -0.654 . . . . 0.0 110.598 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 12' ' ' THR . 61.3 t -128.16 126.02 65.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.348 -0.845 . . . . 0.0 109.659 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.43 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.2 OUTLIER -99.81 138.45 36.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.285 -0.885 . . . . 0.0 110.636 -179.501 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 74.2 p -95.85 171.56 8.57 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.479 -0.763 . . . . 0.0 110.481 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.34 -14.05 24.16 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.4 -0.813 . . . . 0.0 111.164 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.2 p -95.6 -23.6 16.97 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.092 -1.005 . . . . 0.0 110.75 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.59 10.94 8.98 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.3 ttpm? -84.57 137.42 33.31 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.045 -1.268 . . . . 0.0 109.797 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.407 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 10.0 m -113.12 126.31 55.32 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.291 -0.881 . . . . 0.0 110.306 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 10.2 mt -108.96 136.3 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.411 -0.806 . . . . 0.0 110.255 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.4 m -101.85 121.09 41.45 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 109.319 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mt -123.3 159.37 28.94 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.192 -0.943 . . . . 0.0 110.858 -179.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -106.35 113.71 27.39 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.342 -0.849 . . . . 0.0 109.183 179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.655 HG12 ' HD2' ' B' ' 29' ' ' LYS . 33.8 m -140.19 174.34 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.331 -0.856 . . . . 0.0 110.951 -178.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.618 ' O ' HD12 ' B' ' 56' ' ' LEU . 0.4 OUTLIER -112.9 165.41 13.19 Favored Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.637 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.92 -26.97 18.13 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.525 1.276 . . . . 0.0 110.326 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.39 -2.63 57.46 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.231 -0.918 . . . . 0.0 110.522 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.58 142.28 50.03 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.624 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 65.8 p -83.41 160.5 21.58 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.704 . . . . 0.0 110.485 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.674 HG23 HD12 ' B' ' 43' ' ' LEU . 42.0 mm -59.64 -35.64 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.619 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.86 -35.88 75.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.34 -0.85 . . . . 0.0 109.197 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -32.21 69.53 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.536 -0.728 . . . . 0.0 109.29 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 72.4 t -69.96 -42.84 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.499 -0.751 . . . . 0.0 109.387 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -62.88 -40.69 98.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.466 -0.771 . . . . 0.0 109.324 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.73 -36.46 81.03 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.682 179.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.655 ' HD2' HG12 ' B' ' 17' ' ' VAL . 40.4 mttp -68.15 -38.12 81.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.452 -0.78 . . . . 0.0 109.688 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 11.5 mt -67.02 -39.59 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.374 -0.829 . . . . 0.0 109.119 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.2 tm0? -60.48 -48.89 79.79 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.429 -0.794 . . . . 0.0 109.422 178.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.08 -26.55 62.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.44 -0.787 . . . . 0.0 110.25 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -84.07 -39.97 18.9 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -108.03 -55.97 2.3 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.316 -0.865 . . . . 0.0 110.622 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 128.02 15.7 2.29 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.519 HG23 ' HD2' ' B' ' 37' ' ' PRO . 60.7 mt -91.38 144.62 29.99 Favored Pre-proline 0 N--CA 1.493 1.697 0 O-C-N 121.134 -1.215 . . . . 0.0 109.849 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.519 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -69.77 134.64 28.45 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.546 1.287 . . . . 0.0 110.454 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -61.02 -26.59 83.34 Favored 'Trans proline' 0 C--N 1.312 -1.376 0 O-C-N 123.793 1.417 . . . . 0.0 111.152 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.92 -19.67 64.2 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.26 -0.9 . . . . 0.0 110.228 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.465 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 18.4 mp0 -100.98 -9.42 21.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 110.753 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . 0.416 ' HB3' HD11 ' B' ' 69' ' ' LEU . 19.2 mt-30 -94.35 145.7 24.57 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.166 -0.959 . . . . 0.0 110.873 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.463 ' HG2' HD11 ' B' ' 44' ' ' ILE . 3.6 ttt85 -130.18 134.25 47.16 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.514 -0.742 . . . . 0.0 109.522 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.786 ' C ' HD12 ' B' ' 44' ' ' ILE . 25.8 mt -104.34 117.54 34.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.353 -0.842 . . . . 0.0 110.423 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.786 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.1 mp -121.2 133.68 67.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.633 -0.667 . . . . 0.0 109.742 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.419 ' CD1' ' N ' ' B' ' 46' ' ' ALA . 28.4 t80 -140.63 151.44 44.62 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.454 -0.779 . . . . 0.0 109.902 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.419 ' N ' ' CD1' ' B' ' 45' ' ' PHE . . . 45.42 27.41 0.37 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.491 -0.756 . . . . 0.0 111.243 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.81 -0.82 81.16 Favored Glycine 0 N--CA 1.495 2.594 0 C-N-CA 120.175 -1.012 . . . . 0.0 110.605 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.87 136.0 50.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.069 -1.254 . . . . 0.0 110.275 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.5 137.06 37.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.88 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.711 HD22 ' CD2' ' B' ' 59' ' ' TYR . 39.5 mt -84.1 139.9 32.16 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.376 -0.827 . . . . 0.0 110.324 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -93.61 134.71 35.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.306 -0.871 . . . . 0.0 110.465 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.454 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.7 p-10 -48.6 -30.89 5.84 Favored 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.495 -0.753 . . . . 0.0 111.3 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.01 -4.02 90.18 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 110.586 -1.005 . . . . 0.0 110.586 -179.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 23.6 mmt180 -99.63 153.54 18.99 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.053 -1.263 . . . . 0.0 110.652 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 78.4 p -102.33 163.42 12.24 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.333 -0.854 . . . . 0.0 110.222 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.618 HD12 ' O ' ' B' ' 18' ' ' GLU . 71.9 mt -53.52 -43.87 68.68 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.223 -0.923 . . . . 0.0 110.616 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 85.8 p -56.67 -37.33 70.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.389 -0.819 . . . . 0.0 111.051 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.44 -26.46 65.22 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.185 -0.947 . . . . 0.0 110.354 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.711 ' CD2' HD22 ' B' ' 50' ' ' LEU . 70.0 m-85 -101.24 25.11 8.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.177 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t30 50.52 29.21 3.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.477 -0.764 . . . . 0.0 110.726 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.662 HD13 HD21 ' B' ' 67' ' ' LEU . 94.1 mt -81.39 112.45 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 109.759 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -105.57 170.77 7.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.373 -0.829 . . . . 0.0 110.369 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.0 OUTLIER -46.53 151.89 0.51 Allowed 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.56 -0.713 . . . . 0.0 111.04 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 52.2 mm-40 62.86 16.44 9.11 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.714 -0.616 . . . . 0.0 110.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.66 147.7 47.22 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.248 -0.907 . . . . 0.0 110.205 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 32.3 m -107.66 109.22 20.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.374 -0.828 . . . . 0.0 109.878 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.662 HD21 HD13 ' B' ' 61' ' ' ILE . 1.3 mt -102.23 158.85 15.88 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.322 -0.862 . . . . 0.0 110.019 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 79.8 m80 -108.77 131.98 54.43 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.86 . . . . 0.0 110.098 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.416 HD11 ' HB3' ' B' ' 41' ' ' GLN . 31.0 tp -107.19 136.08 47.63 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.35 -0.844 . . . . 0.0 110.009 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.46 HG13 ' HB3' ' A' ' 21' ' ' GLU . 19.0 t -124.7 149.63 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.271 -0.893 . . . . 0.0 110.222 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mt -94.6 122.46 37.21 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.413 -0.804 . . . . 0.0 110.143 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -86.28 66.64 9.63 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.32 -0.863 . . . . 0.0 110.109 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -62.4 172.1 1.66 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.368 -0.833 . . . . 0.0 110.268 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -75.64 126.41 30.95 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.456 -0.778 . . . . 0.0 110.124 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -141.75 34.28 1.89 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 CA-C-O 117.986 -1.452 . . . . 0.0 109.556 -179.959 . . . . . . . . 0 0 . 1 stop_ save_