data_1fyj_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 1fyj _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 120.89 0.376 . . . . 2.22 110.534 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.97 -49.93 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.327 -0.858 . . . . 2.11 109.626 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -60.0 -33.3 71.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.468 -0.77 . . . . 2.46 109.214 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -48.61 79.61 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.473 0.654 . . . . 4.15 110.069 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -61.78 -40.04 93.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.724 -0.61 . . . . 2.09 112.017 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.7 ttt180 -59.98 -51.69 68.6 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.26 -0.9 . . . . 3.44 111.7 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.401 HG11 ' N ' ' A' ' 10' ' ' ALA . 11.5 p -66.87 -40.0 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.126 -0.984 . . . . 1.77 109.389 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.401 ' N ' HG11 ' A' ' 9' ' ' VAL . . . -59.94 -40.92 90.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.737 -0.602 . . . . 0.99 111.081 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.28 -50.02 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.464 -0.772 . . . . 1.59 110.644 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -62.85 -51.79 65.65 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.17 -0.957 . . . . 2.4 109.739 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.1 -51.6 2.73 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.593 -1.003 . . . . 0.41 110.593 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -64.55 -39.02 92.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.899 -0.765 . . . . 1.12 111.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 75.8 t -59.79 -42.75 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.345 -0.847 . . . . 1.2 109.693 -178.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.01 -48.98 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 1.34 109.819 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.0 -42.31 94.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.719 -0.613 . . . . 3.65 110.622 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -61.26 -48.26 82.27 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.605 -0.685 . . . . 2.23 111.244 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.2 mt -60.0 -42.11 93.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.675 -0.64 . . . . 1.66 111.298 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -63.99 -40.02 95.42 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.479 -0.934 . . . . 2.58 108.479 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.48 67.71 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.607 -0.886 . . . . 1.25 108.607 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 36.1 mtpt -85.08 8.92 16.29 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.741 -0.599 . . . . 2.6 110.986 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 55.7 mtmt 58.64 21.54 8.87 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.204 -0.935 . . . . 2.74 110.894 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.66 166.46 1.8 Allowed Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.562 -0.711 . . . . 1.22 110.418 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.76 161.26 46.19 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.436 1.23 . . . . 1.03 110.207 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -56.84 -29.53 62.92 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.557 -0.715 . . . . 2.52 110.63 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.66 -39.88 85.9 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.533 -0.73 . . . . 2.22 110.988 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.07 -44.57 68.86 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 1.46 110.589 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 96.9 t -68.6 -48.56 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.713 -0.617 . . . . 1.37 110.256 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -60.04 -49.49 77.45 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.509 -0.744 . . . . 1.33 111.503 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.77 84.21 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.14 -0.975 . . . . 1.18 110.427 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.13 96.13 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 120.296 -0.561 . . . . 1.16 110.803 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.07 -37.13 79.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.257 -1.016 . . . . 1.28 108.257 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.24 -40.08 88.99 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.924 -0.769 . . . . 3.33 108.924 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.37 -50.68 72.64 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.883 -0.511 . . . . 2.22 110.219 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.21 -38.42 83.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.605 -0.684 . . . . 2.11 109.669 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.7 mt -58.0 -41.31 82.79 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.541 -0.724 . . . . 1.95 109.986 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.8 m -60.27 -39.98 88.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.577 -0.702 . . . . 1.65 109.326 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.2 mt -67.82 -43.21 80.12 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.007 -0.677 . . . . 1.34 109.279 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.01 -39.19 84.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.74 -0.6 . . . . 2.84 109.921 178.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -42.16 91.93 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.262 -0.575 . . . . 1.33 110.453 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.14 -41.39 98.22 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.332 -0.855 . . . . 1.9 109.875 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -40.46 89.58 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.953 0.882 . . . . 2.85 109.541 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -60.03 -34.17 73.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.905 -0.497 . . . . 2.56 111.177 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -56.1 -40.01 73.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.563 -0.711 . . . . 2.41 111.834 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -62.2 -57.83 10.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.085 -1.009 . . . . 2.82 111.329 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.3 m -156.21 25.16 0.36 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.135 -0.978 . . . . 2.76 111.155 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.95 36.27 64.95 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.607 -0.997 . . . . 1.91 110.607 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -85.18 -15.85 42.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.402 -1.058 . . . . 3.05 111.43 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 38.05 -166.37 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.009 0.744 . . . . 2.37 113.009 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.3 t80 . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.184 -0.948 . . . . 3.0 110.207 -179.604 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 121.281 0.562 . . . . 2.22 110.393 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 86.9 t -59.95 -45.53 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.68 -0.638 . . . . 2.11 110.655 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 86.9 mt -59.96 -39.95 87.35 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.374 -0.829 . . . . 2.46 109.868 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -57.63 -38.54 75.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.685 -0.634 . . . . 4.15 109.947 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -60.05 -40.02 88.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.585 -0.697 . . . . 2.09 110.315 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 mtp85 -59.97 -50.99 71.59 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.373 -0.83 . . . . 3.44 110.886 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.403 HG21 ' N ' ' A' ' 10' ' ' ALA . 25.1 m -69.54 -38.09 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 108.238 -1.023 . . . . 1.77 108.238 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.403 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -60.07 -39.33 85.66 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 116.098 -0.501 . . . . 0.99 110.543 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.03 -50.02 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.378 -0.826 . . . . 1.59 109.96 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.44 -50.22 74.45 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.151 -0.968 . . . . 2.4 109.392 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.67 -55.49 3.23 Favored Glycine 0 N--CA 1.507 3.388 0 N-CA-C 110.143 -1.183 . . . . 0.41 110.143 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -65.0 -35.61 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.934 -0.745 . . . . 1.12 110.854 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 86.0 t -60.01 -40.0 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 121.263 -0.898 . . . . 1.2 109.666 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.02 -49.0 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 N-CA-C 108.902 -0.777 . . . . 1.34 108.902 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.8 ttp85 -60.32 -43.12 96.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.866 -0.521 . . . . 3.65 110.444 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.99 -41.7 97.42 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.41 -0.806 . . . . 2.23 111.406 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.76 -40.51 92.74 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.42 -0.8 . . . . 1.66 110.424 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.7 tptt -67.2 -40.09 86.43 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.127 -0.694 . . . . 2.58 109.127 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.46 -26.26 66.63 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.739 -0.837 . . . . 1.25 108.739 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -86.22 9.18 18.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.725 -0.609 . . . . 2.6 110.391 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 56.7 21.37 5.83 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.279 -0.888 . . . . 2.74 111.073 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.24 163.56 5.99 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.586 -0.696 . . . . 1.22 109.933 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.82 162.32 40.08 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 O-C-N 123.484 1.255 . . . . 1.03 111.292 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -55.28 -27.4 46.42 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.754 -0.591 . . . . 2.52 110.258 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -58.66 -40.0 82.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.62 -0.675 . . . . 2.22 110.461 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -71.15 -45.35 63.71 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -0.81 . . . . 1.46 110.869 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 82.5 t -68.55 -50.0 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.497 -0.752 . . . . 1.37 110.164 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -59.98 -46.16 90.34 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 1.33 110.871 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.39 82.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.255 -0.903 . . . . 1.18 110.404 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.15 -42.26 89.28 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 120.086 -0.645 . . . . 1.16 110.496 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.431 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -65.93 -39.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 N-CA-C 108.358 -0.978 . . . . 1.28 108.358 179.331 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -61.06 -42.28 98.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.997 -1.112 . . . . 3.33 107.997 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -65.32 -42.45 92.98 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.833 -1.173 . . . . 2.22 107.833 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.431 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 15.4 tp -60.03 -46.63 88.89 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.737 -0.665 . . . . 2.11 110.0 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.42 -38.4 80.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.272 -0.892 . . . . 1.95 109.575 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 t -59.74 -34.51 73.04 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.644 . . . . 1.65 109.633 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.0 mt -60.0 -48.91 79.76 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.473 -0.767 . . . . 1.34 109.5 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.93 -39.93 91.28 Favored 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.774 0.797 . . . . 2.84 109.109 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -43.97 94.85 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 116.177 -0.465 . . . . 1.33 110.566 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.97 -50.68 72.81 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.302 -0.874 . . . . 1.9 109.655 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.404 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -64.47 -38.28 90.46 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.814 0.816 . . . . 2.85 109.718 178.591 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.9 tttp -60.0 -39.05 84.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.928 -0.483 . . . . 2.56 111.815 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -54.86 -39.03 68.21 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.386 -0.821 . . . . 2.41 112.003 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -62.58 -60.01 4.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.009 -1.057 . . . . 2.82 111.325 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.9 m -156.26 23.47 0.36 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.287 -0.883 . . . . 2.76 110.876 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.04 63.11 3.6 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 109.385 -1.486 . . . . 1.91 109.385 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.404 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 95.7 mm-40 -83.82 -41.5 17.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.495 -1.003 . . . . 3.05 111.823 -179.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 8.0 pt-20 33.54 92.14 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.86 0 CA-C-O 121.584 0.706 . . . . 2.37 112.113 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.3 p90 . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.107 -0.995 . . . . 3.0 111.248 -178.248 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 N--CA 1.496 1.869 0 CA-C-O 121.662 0.744 . . . . 2.22 109.113 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.9 p -58.02 -40.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 121.354 0.597 . . . . 2.11 110.531 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.02 -40.72 90.28 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.373 0.606 . . . . 2.46 110.183 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.407 ' O ' HG21 ' A' ' 9' ' ' VAL . 64.7 t80 -59.52 -40.11 86.09 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.888 -0.508 . . . . 4.15 110.369 -178.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -63.21 -40.41 97.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 2.09 110.259 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -62.42 -49.63 74.71 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.13 -0.981 . . . . 3.44 112.106 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.407 HG21 ' O ' ' A' ' 6' ' ' TYR . 26.6 m -64.83 -42.81 95.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.02 -1.05 . . . . 1.77 110.654 -179.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.76 97.24 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.39 -0.819 . . . . 0.99 111.689 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.5 t -60.09 -47.68 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.454 -0.779 . . . . 1.59 111.132 -177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -60.61 -48.17 82.95 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 119.245 -0.982 . . . . 2.4 109.553 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -38.6 -56.81 1.97 Allowed Glycine 0 N--CA 1.511 3.688 0 N-CA-C 110.175 -1.17 . . . . 0.41 110.175 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.58 -38.49 91.33 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.977 -0.719 . . . . 1.12 111.004 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.1 t -59.87 -44.4 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.816 . . . . 1.2 109.427 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 63.9 t -59.98 -44.99 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 108.386 -0.968 . . . . 1.34 108.386 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -60.45 -41.57 94.35 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.875 -0.515 . . . . 3.65 111.069 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -64.16 -44.51 91.86 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.345 -0.847 . . . . 2.23 111.445 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.32 -41.96 97.88 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.536 -0.727 . . . . 1.66 111.097 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.3 tptt -63.93 -40.02 95.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.361 -0.837 . . . . 2.58 108.993 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.8 67.22 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.58 -0.896 . . . . 1.25 108.58 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 66.0 mttm -84.37 7.38 19.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.729 -0.607 . . . . 2.6 110.852 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 25.9 mmtp 59.28 20.14 8.29 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.172 -0.955 . . . . 2.74 110.938 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.76 162.3 9.6 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.613 -0.68 . . . . 1.22 109.822 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.2 166.48 28.0 Favored 'Trans proline' 0 C--N 1.314 -1.237 0 O-C-N 123.33 1.174 . . . . 1.03 111.133 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.1 -26.87 51.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.747 -0.596 . . . . 2.52 111.005 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.6 -40.04 86.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.478 -0.763 . . . . 2.22 110.557 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.45 -45.93 57.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 1.46 110.933 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.8 t -63.89 -49.89 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.498 -0.751 . . . . 1.37 109.461 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -60.0 -44.92 94.24 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.742 -0.599 . . . . 1.33 111.025 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -50.03 75.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.405 -0.809 . . . . 1.18 110.564 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.38 -45.92 88.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.659 -0.651 . . . . 1.16 110.21 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -35.63 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.28 -1.007 . . . . 1.28 108.28 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -59.94 -43.93 94.68 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.45 -0.944 . . . . 3.33 108.45 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? -64.37 -47.44 79.28 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.356 -0.979 . . . . 2.22 108.356 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 tp -59.95 -40.4 88.87 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 115.613 -0.722 . . . . 2.11 110.032 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.6 mt -59.56 -37.41 78.4 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.538 -0.726 . . . . 1.95 109.919 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.7 m -59.84 -40.11 87.42 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.556 -0.715 . . . . 1.65 109.522 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.7 mt -63.95 -54.84 28.24 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.036 -0.727 . . . . 1.34 109.036 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.85 -34.65 74.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.565 0.698 . . . . 2.84 109.404 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.88 -38.78 83.19 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.845 -0.535 . . . . 1.33 110.299 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -40.82 84.59 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.24 -0.913 . . . . 1.9 109.884 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -60.39 -45.93 91.8 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.584 -0.698 . . . . 2.85 111.389 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.38 -19.12 61.52 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.327 -0.858 . . . . 2.56 112.034 -178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -59.35 -39.98 84.96 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.365 -0.834 . . . . 2.41 110.745 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.23 -57.42 10.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.575 -0.703 . . . . 2.82 111.092 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.2 m -151.51 19.29 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.236 -0.915 . . . . 2.76 110.776 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.4 39.31 80.68 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.656 -1.378 . . . . 1.91 109.656 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 50' ' ' GLU . 96.6 mm-40 -90.2 -15.39 31.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.606 -0.937 . . . . 3.05 112.2 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' O ' ' A' ' 49' ' ' GLN . 14.8 pt-20 39.75 -176.33 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.608 0 N-CA-C 113.274 0.842 . . . . 2.37 113.274 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.9 t80 . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.944 -1.098 . . . . 3.0 110.724 -179.577 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.6 tp . . . . . 0 N--CA 1.498 1.972 0 CA-C-O 121.505 0.669 . . . . 2.22 109.807 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.75 -46.66 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 C-N-CA 120.441 -0.503 . . . . 2.11 109.872 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -42.51 93.31 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.313 -0.867 . . . . 2.46 109.343 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -59.89 -39.93 87.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.67 -0.644 . . . . 4.15 110.15 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.03 -39.98 87.76 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.29 -0.882 . . . . 2.09 110.286 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -59.99 -47.3 86.37 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.689 -0.632 . . . . 3.44 110.892 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.437 HG23 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -69.12 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.122 -0.986 . . . . 1.77 109.434 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.527 -0.733 . . . . 0.99 110.486 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.96 -49.04 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.737 -0.602 . . . . 1.59 110.756 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.41 ' CG ' HD22 ' A' ' 36' ' ' LEU . 0.9 OUTLIER -60.02 -50.09 75.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.479 -0.763 . . . . 2.4 109.577 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.93 -55.01 4.23 Favored Glycine 0 N--CA 1.507 3.368 0 N-CA-C 110.49 -1.044 . . . . 0.41 110.49 -178.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -63.34 -35.26 79.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.844 -0.797 . . . . 1.12 111.923 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 72.5 t -59.99 -43.58 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.23 -0.919 . . . . 1.2 109.828 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.403 HG21 ' CB ' ' A' ' 32' ' ' ALA . 62.5 t -59.99 -44.53 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.457 -0.777 . . . . 1.34 109.597 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.675 -0.641 . . . . 3.65 110.806 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.01 -44.03 94.82 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.441 -0.787 . . . . 2.23 111.414 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.6 mp -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.328 -0.858 . . . . 1.66 110.337 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -62.58 -39.97 95.38 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.196 -0.668 . . . . 2.58 109.196 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.3 -25.48 67.14 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.583 -0.895 . . . . 1.25 108.583 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.29 6.86 24.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.747 -0.596 . . . . 2.6 110.399 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 55.41 25.82 8.11 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.231 -0.918 . . . . 2.74 110.812 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.47 170.33 0.81 Allowed Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.761 -0.587 . . . . 1.22 110.061 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.26 154.85 61.42 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.33 1.174 . . . . 1.03 110.012 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -54.47 -24.79 21.78 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.36 -0.837 . . . . 2.52 111.159 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.521 -0.737 . . . . 2.22 110.438 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -72.6 -46.44 54.23 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.457 -0.777 . . . . 1.46 110.974 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.8 t -66.04 -49.72 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.648 -0.657 . . . . 1.37 110.608 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -59.93 -50.92 71.87 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.388 -0.82 . . . . 1.33 111.625 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.46 90.02 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.038 -1.039 . . . . 1.18 110.399 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.403 ' CB ' HG21 ' A' ' 16' ' ' VAL . . . -65.3 -39.98 93.19 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 120.319 -0.552 . . . . 1.16 110.766 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.45 -38.89 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.217 -0.927 . . . . 1.28 109.26 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -60.0 -35.29 74.72 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.754 0.788 . . . . 3.33 109.113 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -59.95 -40.05 87.66 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.408 0.623 . . . . 2.22 109.587 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.41 HD22 ' CG ' ' A' ' 12' ' ' GLN . 35.3 mt -59.25 -40.03 84.69 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 120.115 -0.634 . . . . 2.11 109.706 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.7 mp -58.99 -34.67 72.1 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.477 -0.764 . . . . 1.95 109.619 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.6 t -59.96 -39.98 87.46 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.903 -0.777 . . . . 1.65 108.903 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.95 -49.98 75.53 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.629 -0.878 . . . . 1.34 108.629 178.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -62.2 -33.03 73.77 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.916 -0.772 . . . . 2.84 108.916 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.01 95.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 1.33 109.748 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -61.26 -44.22 97.6 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.231 -1.026 . . . . 1.9 108.231 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.61 -41.2 94.34 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.545 0.688 . . . . 2.85 109.859 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -60.0 -36.35 77.0 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.714 -0.616 . . . . 2.56 111.486 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -56.27 -40.02 73.58 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.322 -0.861 . . . . 2.41 110.745 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.09 -62.83 1.23 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.701 -0.8 . . . . 2.82 110.795 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.2 t -165.78 29.39 0.05 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.303 -0.873 . . . . 2.76 111.613 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.05 63.87 3.42 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 109.136 -1.586 . . . . 1.91 109.136 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 99.6 mt-30 -83.11 -32.15 26.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.656 -0.909 . . . . 3.05 110.462 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 32.31 98.48 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 113.38 0.881 . . . . 2.37 113.38 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.2 p90 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.148 -0.97 . . . . 3.0 110.513 -179.848 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.659 0.742 . . . . 2.22 109.82 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.03 -41.93 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.928 -0.483 . . . . 2.11 111.146 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -59.98 -47.97 83.65 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.317 -0.864 . . . . 2.46 110.149 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -57.42 -38.31 74.16 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.522 -0.736 . . . . 4.15 110.418 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.01 -40.08 88.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.522 -0.736 . . . . 2.09 110.563 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -60.02 -48.89 79.83 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.457 -0.777 . . . . 3.44 110.835 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.6 m -65.77 -39.92 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 C-N-CA 119.327 -0.949 . . . . 1.77 109.715 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -40.54 98.06 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.493 -0.754 . . . . 0.99 110.55 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.8 t -60.66 -42.72 92.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.655 -0.653 . . . . 1.59 110.777 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -62.89 -56.44 17.29 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.132 -0.98 . . . . 2.4 109.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -37.71 -52.74 1.93 Allowed Glycine 0 N--CA 1.512 3.763 0 N-CA-C 110.717 -0.953 . . . . 0.41 110.717 -178.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -61.71 -38.73 88.94 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.976 -0.72 . . . . 1.12 110.941 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.96 -40.18 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.324 -0.86 . . . . 1.2 110.023 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 71.8 t -60.04 -49.96 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 121.024 -1.047 . . . . 1.34 108.805 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 68.1 ttt-85 -60.07 -44.44 94.75 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 121.459 0.647 . . . . 3.65 110.167 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.14 -48.31 82.26 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.81 -0.556 . . . . 2.23 110.737 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.97 -46.07 90.62 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 120.043 -0.663 . . . . 1.66 110.105 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -66.31 -39.99 89.65 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.414 -0.958 . . . . 2.58 108.414 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.73 -30.55 70.84 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 108.675 -0.861 . . . . 1.25 108.675 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 61.1 mtpt -85.6 10.72 12.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.44 -0.504 . . . . 2.6 110.873 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.2 mtmt 59.91 20.14 9.13 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.302 -0.874 . . . . 2.74 111.195 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.4 165.19 4.18 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.554 -0.716 . . . . 1.22 109.953 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.61 160.55 49.08 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.32 1.168 . . . . 1.03 111.349 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.405 ' O ' HG11 ' A' ' 29' ' ' VAL . 33.9 mtpt -55.83 -25.71 43.12 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.574 -0.704 . . . . 2.52 110.446 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -59.98 -39.91 87.3 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.152 -0.968 . . . . 2.22 109.953 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -70.0 -49.63 49.57 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.437 -0.789 . . . . 1.46 111.42 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.407 ' CG1' ' N ' ' A' ' 30' ' ' ASP . 8.4 p -65.05 -43.25 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.406 -0.809 . . . . 1.37 110.221 -179.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.407 ' N ' ' CG1' ' A' ' 29' ' ' VAL . 95.6 m-20 -60.03 -41.75 92.89 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.8 -0.562 . . . . 1.33 110.792 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.64 -50.11 72.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.447 -0.783 . . . . 1.18 110.797 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.46 -41.52 93.3 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 120.182 -0.607 . . . . 1.16 110.331 -179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.413 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -67.12 -38.87 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 107.412 -1.329 . . . . 1.28 107.412 178.498 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -60.43 -46.36 90.33 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.342 -0.984 . . . . 3.33 108.342 177.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -64.23 -40.92 97.04 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.095 -1.076 . . . . 2.22 108.095 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 17.2 tp -60.0 -40.33 88.84 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 115.626 -0.715 . . . . 2.11 110.322 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.5 mt -59.96 -40.0 87.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.219 -0.926 . . . . 1.95 109.722 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.3 m -60.44 -37.02 79.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.424 -0.798 . . . . 1.65 109.347 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -59.98 -56.24 24.1 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.672 -0.643 . . . . 1.34 110.439 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 17.6 ptmt -62.11 -35.88 80.06 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.317 -0.865 . . . . 2.84 109.23 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.421 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -60.76 -43.77 97.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.112 -0.495 . . . . 1.33 110.488 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.04 -47.6 85.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.111 -0.993 . . . . 1.9 109.259 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.437 ' CE2' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -61.22 -38.7 87.54 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.498 -0.751 . . . . 2.85 109.042 178.081 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.8 ttpt -60.34 -27.27 67.23 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.749 -0.594 . . . . 2.56 111.081 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -55.6 -37.76 68.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.26 -0.9 . . . . 2.41 110.961 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -62.82 -77.71 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.443 -0.786 . . . . 2.82 110.014 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 t -161.49 40.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.31 -0.869 . . . . 2.76 110.241 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.71 65.75 2.4 Favored Glycine 0 N--CA 1.496 2.698 0 N-CA-C 109.972 -1.251 . . . . 1.91 109.972 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.437 ' HB3' ' CE2' ' A' ' 43' ' ' TYR . 81.6 mm-40 -86.43 -21.75 26.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.467 -1.019 . . . . 3.05 111.608 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 9.0 pt-20 32.21 92.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 112.811 0.671 . . . . 2.37 112.811 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.2 p90 . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.126 -0.984 . . . . 3.0 110.716 -179.217 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.9 tt . . . . . 0 N--CA 1.502 2.153 0 N-CA-C 112.474 0.546 . . . . 2.22 112.474 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.408 HG11 ' N ' ' A' ' 5' ' ' LEU . 14.7 p -58.64 -39.5 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.089 -1.007 . . . . 2.11 110.251 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.439 HD12 ' CZ ' ' A' ' 43' ' ' TYR . 0.5 OUTLIER -58.93 -39.96 83.18 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 109.394 -0.595 . . . . 2.46 109.394 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.409 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 m-85 -59.11 -38.26 79.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.614 -0.679 . . . . 4.15 110.103 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -60.04 -40.75 90.48 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.14 -0.975 . . . . 2.09 109.938 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -60.01 -49.52 77.32 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.762 -0.586 . . . . 3.44 110.715 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.473 HG21 ' N ' ' A' ' 10' ' ' ALA . 26.5 m -66.76 -39.46 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.391 -0.818 . . . . 1.77 109.565 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.473 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -60.51 -37.1 80.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.534 -0.728 . . . . 0.99 110.319 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 64.2 t -60.01 -49.95 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.625 -0.672 . . . . 1.59 109.76 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.37 -56.13 21.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.353 -0.842 . . . . 2.4 109.876 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -36.42 -52.5 1.35 Allowed Glycine 0 N--CA 1.514 3.866 0 N-CA-C 110.907 -0.877 . . . . 0.41 110.907 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -62.26 -37.93 87.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.884 -0.774 . . . . 1.12 111.289 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 76.2 t -59.52 -40.56 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.329 -0.857 . . . . 1.2 109.469 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.1 t -59.98 -49.6 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.4 -0.812 . . . . 1.34 109.004 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -60.0 -43.48 95.19 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.581 -0.699 . . . . 3.65 110.423 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -60.4 -39.5 87.57 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.481 -0.762 . . . . 2.23 111.255 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.02 -40.5 89.54 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.374 -0.829 . . . . 1.66 110.924 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -66.24 -40.26 90.1 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.35 -0.844 . . . . 2.58 109.326 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.39 66.93 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.171 -1.048 . . . . 1.25 108.171 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 48.7 mtpt -86.33 9.44 17.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.715 -0.616 . . . . 2.6 111.007 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 57.9 mtpt 58.08 24.77 11.6 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.28 -0.888 . . . . 2.74 110.822 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 157.99 40.65 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.777 -0.577 . . . . 1.22 110.3 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.52 167.44 27.03 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.433 1.228 . . . . 1.03 110.478 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -56.63 -31.86 64.76 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.732 -0.605 . . . . 2.52 109.778 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -59.71 -40.05 86.66 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.637 -0.664 . . . . 2.22 110.533 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -69.81 -42.45 73.69 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.291 -0.881 . . . . 1.46 110.049 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.8 t -67.68 -48.95 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 CA-C-O 121.39 0.614 . . . . 1.37 109.773 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -59.92 -46.87 87.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.658 -0.652 . . . . 1.33 111.198 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.29 -47.72 84.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.333 -0.855 . . . . 1.18 110.758 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.75 -44.99 88.32 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.497 -0.752 . . . . 1.16 110.247 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -38.51 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.031 -1.1 . . . . 1.28 108.031 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.06 -45.5 92.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 108.07 -1.085 . . . . 3.33 108.07 177.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -63.57 -43.15 97.84 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 122.117 0.961 . . . . 2.22 108.604 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.4 tp -59.96 -42.44 94.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.833 -0.621 . . . . 2.11 110.096 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.03 -38.72 83.55 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.499 -0.75 . . . . 1.95 110.384 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 p -59.98 -37.57 80.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.365 -0.835 . . . . 1.65 109.337 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.7 mt -62.23 -52.93 61.8 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.609 -0.886 . . . . 1.34 108.609 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.58 -38.37 84.37 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.42 0.629 . . . . 2.84 109.361 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.39 93.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.757 -0.59 . . . . 1.33 109.762 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -60.08 -44.9 94.43 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.617 -0.882 . . . . 1.9 108.617 178.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.439 ' CZ ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -60.19 -43.34 95.98 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.433 0.635 . . . . 2.85 110.101 178.358 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.54 -29.03 68.88 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.722 -0.611 . . . . 2.56 111.793 -179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -55.97 -39.97 72.58 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.288 -0.882 . . . . 2.41 111.212 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.31 -64.39 0.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.397 -0.815 . . . . 2.82 110.79 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -165.94 32.79 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.383 -0.823 . . . . 2.76 110.994 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.59 70.58 1.2 Allowed Glycine 0 N--CA 1.498 2.788 0 N-CA-C 110.398 -1.081 . . . . 1.91 110.398 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 50' ' ' GLU . 60.6 mm-40 -85.92 -28.01 24.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.537 -0.978 . . . . 3.05 110.405 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.492 ' O ' ' O ' ' A' ' 49' ' ' GLN . 16.2 pt-20 39.47 114.98 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 122.892 1.33 . . . . 2.37 113.088 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 10' ' ' ALA . 13.9 t80 . . . . . 0 N--CA 1.498 1.949 0 O-C-N 120.844 -1.16 . . . . 3.0 110.668 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 37.5 tp . . . . . 0 N--CA 1.499 1.98 0 CA-C-O 121.123 0.487 . . . . 2.22 110.845 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.9 p -59.56 -46.36 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.59 -0.694 . . . . 2.11 110.904 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 85.0 mt -61.38 -40.03 92.83 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.346 -0.846 . . . . 2.46 109.404 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 51' ' ' TYR . 32.3 t80 -59.93 -39.85 86.93 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.045 -0.724 . . . . 4.15 109.045 178.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.14 -39.88 87.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.408 -0.807 . . . . 2.09 109.995 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -58.94 -49.97 75.82 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.382 -0.824 . . . . 3.44 110.431 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.424 HG21 ' N ' ' A' ' 10' ' ' ALA . 28.0 m -68.43 -38.19 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.156 -0.965 . . . . 1.77 108.626 178.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -59.98 -38.15 81.71 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.745 -0.597 . . . . 0.99 110.346 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.03 -50.38 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.678 -0.639 . . . . 1.59 110.78 -178.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -61.72 -49.24 77.26 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.202 -0.999 . . . . 2.4 109.923 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -45.04 -48.65 9.65 Favored Glycine 0 N--CA 1.506 3.333 0 N-CA-C 109.561 -1.415 . . . . 0.41 109.561 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -64.04 -35.99 82.52 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.889 -0.771 . . . . 1.12 110.742 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.01 -40.05 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.414 -0.804 . . . . 1.2 109.809 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.1 t -59.98 -49.72 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 108.247 -1.019 . . . . 1.34 108.247 178.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -60.04 -45.34 93.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.696 -0.627 . . . . 3.65 110.211 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.94 -40.04 91.75 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.62 -0.675 . . . . 2.23 111.063 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 71.9 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.433 -0.792 . . . . 1.66 110.685 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.6 mmtp -63.37 -40.06 96.23 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.164 -0.68 . . . . 2.58 109.164 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.55 -26.39 68.68 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.522 -0.918 . . . . 1.25 108.522 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 76.5 mttt -86.03 8.73 19.49 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.791 -0.568 . . . . 2.6 110.629 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 48.3 mttp 59.31 20.03 8.22 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.308 -0.87 . . . . 2.74 110.545 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.58 155.9 56.97 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.59 -0.694 . . . . 1.22 110.013 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.45 160.36 50.08 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.434 1.229 . . . . 1.03 110.454 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -55.05 -26.49 37.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.498 -0.751 . . . . 2.52 110.53 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -59.95 -40.01 87.52 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.577 -0.702 . . . . 2.22 110.898 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -69.86 -43.12 72.52 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.404 -0.81 . . . . 1.46 111.023 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.4 t -68.02 -43.79 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 1.37 110.287 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -59.99 -43.52 95.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -0.754 . . . . 1.33 111.322 -179.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.66 83.96 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.378 -0.826 . . . . 1.18 110.928 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.48 -40.14 95.11 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 120.006 -0.677 . . . . 1.16 110.686 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -39.96 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 119.487 -0.885 . . . . 1.28 108.881 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -60.44 -40.95 92.97 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.198 -1.038 . . . . 3.33 108.198 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.3 -39.57 93.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.303 -0.999 . . . . 2.22 108.303 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -57.88 -40.01 79.21 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 116.033 -0.53 . . . . 2.11 109.851 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mp -56.77 -39.11 73.46 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.172 -0.955 . . . . 1.95 109.005 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.4 t -59.96 -39.65 86.34 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.87 -0.789 . . . . 1.65 108.87 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.7 mt -64.31 -39.8 94.63 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.935 -0.765 . . . . 1.34 108.935 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -59.25 -37.37 77.44 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.805 -0.559 . . . . 2.84 109.593 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.95 -39.99 87.46 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.585 -0.697 . . . . 1.33 109.799 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.53 -41.77 92.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.298 -0.876 . . . . 1.9 109.614 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.414 ' CE2' ' HA ' ' A' ' 51' ' ' TYR . 53.1 t80 -60.01 -47.24 86.63 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.653 -0.655 . . . . 2.85 111.782 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.457 ' HG3' ' N ' ' A' ' 45' ' ' GLU . 0.5 OUTLIER -55.67 -28.75 57.2 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.562 -0.711 . . . . 2.56 111.614 -177.037 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.457 ' N ' ' HG3' ' A' ' 44' ' ' LYS . 58.1 mm-40 -60.02 -39.93 87.58 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.256 -0.903 . . . . 2.41 110.5 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -63.31 -52.78 60.5 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.513 -0.742 . . . . 2.82 112.238 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 m -156.37 -70.92 0.11 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.011 -1.056 . . . . 2.76 112.767 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -86.63 -113.83 0.91 Allowed Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.926 -1.13 . . . . 1.91 113.2 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.426 ' HA ' ' CB ' ' A' ' 44' ' ' LYS . 32.9 mt-30 -140.98 -30.26 0.64 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.994 -0.71 . . . . 3.05 112.87 -176.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -158.02 155.74 29.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.086 -1.009 . . . . 2.37 111.425 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.435 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 51.7 p90 . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.693 -0.629 . . . . 3.0 110.454 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 120.706 0.289 . . . . 2.22 110.511 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 84.5 t -59.93 -49.79 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.201 -0.937 . . . . 2.11 109.094 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.04 -38.12 81.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.639 -0.663 . . . . 2.46 109.927 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -59.98 -40.0 87.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.599 -0.688 . . . . 4.15 110.127 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -60.02 -39.64 86.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.499 -0.751 . . . . 2.09 110.23 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -59.97 -51.11 71.07 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.38 -0.825 . . . . 3.44 110.534 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.405 ' HA ' ' CD1' ' A' ' 39' ' ' LEU . 8.3 p -69.04 -42.5 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.452 -0.78 . . . . 1.77 109.785 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.05 -47.61 85.15 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.543 -0.723 . . . . 0.99 111.269 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -60.02 -48.13 89.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.61 -0.681 . . . . 1.59 110.732 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.24 -55.17 31.02 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.194 -0.941 . . . . 2.4 109.709 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.94 -55.02 2.92 Favored Glycine 0 N--CA 1.508 3.445 0 N-CA-C 111.095 -0.802 . . . . 0.41 111.095 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -63.87 -38.46 91.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.75 -0.853 . . . . 1.12 111.377 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 72.6 t -59.46 -40.05 80.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.459 -0.776 . . . . 1.2 109.683 -178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.96 -50.05 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.271 -0.893 . . . . 1.34 108.67 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.6 ttp85 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.604 -0.685 . . . . 3.65 109.967 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -60.11 -45.14 93.96 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.626 -0.671 . . . . 2.23 110.442 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.95 -40.09 87.8 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.401 0.62 . . . . 1.66 110.088 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.4 tptm -63.33 -40.15 96.53 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.018 -0.734 . . . . 2.58 109.018 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.44 -27.81 68.78 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.214 -1.032 . . . . 1.25 108.214 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 59.5 mtpt -86.37 9.11 18.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.765 -0.585 . . . . 2.6 110.904 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 56.1 mttm 59.32 22.11 10.44 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.28 -0.887 . . . . 2.74 110.9 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.27 161.09 10.6 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.603 -0.686 . . . . 1.22 110.397 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.12 158.3 52.42 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.462 1.243 . . . . 1.03 110.143 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -55.48 -28.06 52.21 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.501 -0.75 . . . . 2.52 110.448 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -59.33 -41.63 89.56 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.624 -0.672 . . . . 2.22 110.352 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -70.5 -42.78 70.89 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.489 -0.757 . . . . 1.46 110.37 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 65.7 t -68.86 -49.39 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.726 -0.609 . . . . 1.37 110.522 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.08 -43.23 95.64 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.433 -0.792 . . . . 1.33 111.491 -179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -49.99 75.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.308 -0.87 . . . . 1.18 110.707 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.32 -41.57 93.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.188 -0.605 . . . . 1.16 110.548 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -38.44 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 108.262 -1.014 . . . . 1.28 108.262 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -60.82 -41.21 95.28 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.687 -0.857 . . . . 3.33 108.687 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.1 tp60 -64.69 -41.93 95.68 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.221 -1.029 . . . . 2.22 108.221 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.01 -41.18 91.59 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 116.065 -0.516 . . . . 2.11 110.093 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.9 mt -59.6 -40.01 86.06 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.409 -0.807 . . . . 1.95 109.946 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.6 m -60.08 -39.99 88.01 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.593 -0.692 . . . . 1.65 109.255 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.405 ' CD1' ' HA ' ' A' ' 9' ' ' VAL . 64.7 mt -65.1 -46.5 80.82 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.453 -0.943 . . . . 1.34 108.453 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -60.04 -40.98 91.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.926 -0.484 . . . . 2.84 110.348 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.05 -40.44 97.7 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.527 -0.733 . . . . 1.33 110.285 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -66.76 -39.98 88.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.52 -0.737 . . . . 1.9 110.037 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -43.62 95.14 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.542 -0.724 . . . . 2.85 109.952 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -63.71 -27.6 69.32 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.668 -0.645 . . . . 2.56 111.81 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -39.57 69.3 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.151 -0.968 . . . . 2.41 110.911 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -62.24 -58.41 7.85 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.568 -0.708 . . . . 2.82 110.276 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.4 t -161.43 29.57 0.13 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.461 -0.774 . . . . 2.76 110.377 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.46 47.64 27.37 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.526 -1.03 . . . . 1.91 110.526 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -85.71 -11.43 53.71 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.356 -1.085 . . . . 3.05 111.163 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 35.97 -157.76 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.689 0 N-CA-C 112.519 0.562 . . . . 2.37 112.519 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.4 ' CD2' HG21 ' A' ' 9' ' ' VAL . 33.4 t80 . . . . . 0 N--CA 1.495 1.819 0 O-C-N 121.275 -0.891 . . . . 3.0 109.919 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 120.639 0.257 . . . . 2.22 111.197 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 29.6 m -54.93 -43.42 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.212 -0.93 . . . . 2.11 110.622 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.9 -40.1 91.81 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.453 -0.779 . . . . 2.46 109.69 178.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.404 ' O ' HG23 ' A' ' 9' ' ' VAL . 5.4 t80 -59.66 -39.37 84.2 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.542 0.687 . . . . 4.15 110.028 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -59.97 -39.34 85.32 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.756 . . . . 2.09 110.048 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.4 mmm-85 -60.01 -49.91 75.8 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.768 . . . . 3.44 110.519 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.447 HG22 ' N ' ' A' ' 10' ' ' ALA . 32.9 m -67.19 -40.07 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 C-N-CA 119.235 -0.986 . . . . 1.77 108.417 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -61.65 -39.96 93.2 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.756 -0.59 . . . . 0.99 111.437 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.6 t -59.99 -52.16 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.481 -0.762 . . . . 1.59 111.411 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 96.5 mm-40 -60.17 -47.28 86.6 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.242 -0.911 . . . . 2.4 110.477 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.54 -52.59 4.47 Favored Glycine 0 N--CA 1.509 3.531 0 N-CA-C 109.936 -1.266 . . . . 0.41 109.936 -178.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -65.97 -37.04 84.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 122.122 -0.634 . . . . 1.12 111.256 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.3 t -60.02 -40.31 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.315 -0.866 . . . . 1.2 109.689 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.04 -49.91 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 108.878 -0.786 . . . . 1.34 108.878 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.57 -43.0 97.77 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.612 -0.68 . . . . 3.65 110.784 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -61.63 -44.24 97.36 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.408 -0.807 . . . . 2.23 111.084 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 85.9 mt -60.04 -39.97 87.76 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.427 0.632 . . . . 1.66 110.464 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -65.98 -39.99 90.83 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.253 0.549 . . . . 2.58 109.571 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.55 66.85 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 108.918 -0.771 . . . . 1.25 108.918 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 9.1 mtmt -86.69 10.14 16.64 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.614 -0.835 . . . . 2.6 111.001 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 72.9 mmtt 58.85 21.99 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.228 -0.92 . . . . 2.74 110.812 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.68 160.33 10.63 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.516 -0.74 . . . . 1.22 109.944 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.38 167.77 26.37 Favored 'Trans proline' 0 C--N 1.316 -1.168 0 O-C-N 123.359 1.189 . . . . 1.03 109.838 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -53.92 -22.65 10.6 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.544 -0.722 . . . . 2.52 110.364 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -55.74 -45.71 77.94 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.54 -0.725 . . . . 2.22 110.27 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -72.22 -40.9 67.46 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.546 -0.721 . . . . 1.46 111.113 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 55.9 t -68.29 -47.61 77.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.488 -0.758 . . . . 1.37 110.214 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -59.94 -46.43 89.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.715 . . . . 1.33 110.951 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.47 -49.96 73.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.406 -0.809 . . . . 1.18 110.649 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.58 -42.47 95.6 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.042 -0.663 . . . . 1.16 110.358 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -37.84 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.465 -0.939 . . . . 1.28 108.465 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -59.97 -37.87 80.86 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.902 0.858 . . . . 3.33 108.881 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -60.0 -41.56 92.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.936 -0.477 . . . . 2.22 109.761 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.441 ' HG ' ' HB3' ' A' ' 12' ' ' GLN . 22.6 mt -59.15 -39.97 84.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.837 -0.539 . . . . 2.11 110.771 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.32 -40.58 82.45 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.519 -0.738 . . . . 1.95 110.032 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.5 m -62.35 -39.99 94.94 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.744 -0.783 . . . . 1.65 109.644 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.6 mt -66.9 -51.49 54.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.644 . . . . 1.34 109.379 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -60.72 -39.96 90.54 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.753 -0.592 . . . . 2.84 109.735 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.1 -42.51 94.82 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.885 -0.509 . . . . 1.33 111.042 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -70.03 -43.15 71.88 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.324 -0.86 . . . . 1.9 110.749 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.429 ' CD1' ' CB ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -62.02 -49.02 77.69 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 2.85 112.352 -179.335 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -59.7 -23.16 62.9 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.225 -0.922 . . . . 2.56 111.429 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -60.04 -39.99 87.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.418 -0.801 . . . . 2.41 110.807 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.99 -60.06 2.79 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.374 -0.93 . . . . 2.82 110.561 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.7 m -160.18 45.29 0.22 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.148 -0.97 . . . . 2.76 111.868 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.38 42.08 96.17 Favored Glycine 0 N--CA 1.5 2.911 0 N-CA-C 109.073 -1.611 . . . . 1.91 109.073 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.429 ' CB ' ' CD1' ' A' ' 43' ' ' TYR . 93.8 mt-30 -96.76 28.35 3.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.703 -0.88 . . . . 3.05 110.939 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -52.41 178.44 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.712 -0.617 . . . . 2.37 110.849 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.1 t80 . . . . . 0 N--CA 1.5 2.059 0 O-C-N 121.541 -0.724 . . . . 3.0 111.519 -178.351 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.8 tp . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 121.4 0.619 . . . . 2.22 109.872 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.4 t -59.82 -41.06 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.88 -0.513 . . . . 2.11 110.421 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 mt -60.01 -43.5 95.19 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.251 -0.906 . . . . 2.46 109.843 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.02 -39.11 84.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.611 -0.68 . . . . 4.15 109.75 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -60.99 -40.64 94.27 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 2.09 110.719 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.7 -50.39 73.67 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.298 -0.876 . . . . 3.44 110.956 -179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.419 HG22 ' CD2' ' A' ' 51' ' ' TYR . 17.5 m -70.14 -40.57 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 1.77 108.472 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.84 -50.54 73.01 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 112.89 0.7 . . . . 0.99 112.89 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.8 m -60.2 -45.2 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.169 -0.957 . . . . 1.59 111.827 -177.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -60.15 -50.39 73.88 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.049 -1.032 . . . . 2.4 110.372 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -45.79 -41.69 10.34 Favored Glycine 0 N--CA 1.507 3.372 0 N-CA-C 109.302 -1.519 . . . . 0.41 109.302 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -66.16 -37.44 85.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 122.097 -0.649 . . . . 1.12 110.908 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.1 t -60.01 -40.87 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.53 -0.731 . . . . 1.2 110.012 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.5 t -60.69 -46.36 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.281 -0.887 . . . . 1.34 109.045 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -59.95 -40.06 87.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.571 -0.705 . . . . 3.65 110.654 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -59.99 -42.82 95.06 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.546 -0.721 . . . . 2.23 110.059 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.03 -40.03 87.92 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.752 -0.592 . . . . 1.66 110.577 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -60.63 -44.19 96.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.33 -0.856 . . . . 2.58 109.093 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.26 68.55 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.312 -0.996 . . . . 1.25 108.312 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -85.48 8.21 19.95 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.761 -0.587 . . . . 2.6 110.764 179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt 58.46 21.61 8.67 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.242 -0.911 . . . . 2.74 110.755 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.61 148.68 80.91 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.633 -0.667 . . . . 1.22 110.183 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -70.36 168.2 23.03 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.418 1.22 . . . . 1.03 110.898 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.3 mmmt -55.92 -30.74 62.1 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.811 -0.555 . . . . 2.52 110.84 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -59.09 -40.02 83.98 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.498 -0.751 . . . . 2.22 110.532 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -71.48 -44.07 65.43 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.433 -0.792 . . . . 1.46 110.478 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.08 -40.58 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.69 -0.631 . . . . 1.37 110.328 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -59.27 -47.84 83.86 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.334 -0.853 . . . . 1.33 111.084 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.71 -49.67 75.53 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.114 -0.991 . . . . 1.18 110.651 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.21 -40.14 90.13 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.691 -0.63 . . . . 1.16 110.879 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -38.37 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 108.516 -0.92 . . . . 1.28 108.516 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -60.49 -40.0 89.74 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.527 -0.733 . . . . 3.33 109.197 177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -61.23 -53.07 61.51 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.704 -0.623 . . . . 2.22 109.666 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.16 -40.09 88.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.657 -0.652 . . . . 2.11 109.644 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.06 -39.97 87.84 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.391 -0.818 . . . . 1.95 109.583 179.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -59.99 -39.47 85.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 1.65 109.391 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.6 mt -59.96 -55.21 36.86 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.618 -0.676 . . . . 1.34 110.581 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.7 pttp -65.77 -29.96 70.54 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.175 -0.953 . . . . 2.84 109.428 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.59 92.52 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.295 -0.562 . . . . 1.33 109.645 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -63.83 -44.64 92.63 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.233 -1.025 . . . . 1.9 108.233 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -60.42 -41.65 94.4 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.623 0.725 . . . . 2.85 109.836 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.98 -39.75 86.79 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.829 -0.545 . . . . 2.56 111.237 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -55.68 -40.01 71.73 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.347 -0.846 . . . . 2.41 111.187 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -63.71 -85.01 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.234 -0.916 . . . . 2.82 110.623 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.4 t -159.97 51.75 0.33 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.014 -1.054 . . . . 2.76 111.705 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.28 41.22 69.11 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.616 -0.994 . . . . 1.91 110.616 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -95.56 23.18 6.27 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.47 -1.017 . . . . 3.05 111.048 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.9 141.18 55.94 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.592 0.711 . . . . 2.37 110.236 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.419 ' CD2' HG22 ' A' ' 9' ' ' VAL . 55.6 p90 . . . . . 0 N--CA 1.499 1.986 0 CA-C-O 121.502 0.668 . . . . 3.0 111.452 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 120.94 0.4 . . . . 2.22 110.556 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 5' ' ' LEU . 7.8 p -55.27 -43.48 71.15 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.417 -0.802 . . . . 2.11 110.48 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.412 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 81.1 mt -60.2 -40.0 88.56 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.637 -0.664 . . . . 2.46 109.428 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.03 -47.58 80.57 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-O 121.488 0.661 . . . . 4.15 109.599 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -62.43 -40.07 95.36 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.622 -0.674 . . . . 2.09 110.799 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.422 ' O ' HG21 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -59.97 -49.89 75.88 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.408 -0.808 . . . . 3.44 110.647 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.418 HG21 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -69.03 -40.0 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 1.77 109.23 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.418 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -59.97 -49.74 76.48 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.79 0.663 . . . . 0.99 112.79 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 8' ' ' ARG . 34.2 m -59.88 -45.38 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.172 -0.955 . . . . 1.59 111.037 -177.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -60.93 -49.46 77.37 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.106 -0.996 . . . . 2.4 109.673 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.53 -58.85 2.04 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.408 -1.077 . . . . 0.41 110.408 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -63.64 -36.29 83.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.835 -0.803 . . . . 1.12 111.028 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 90.1 t -60.01 -40.48 83.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.332 -0.855 . . . . 1.2 109.579 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.5 t -60.2 -50.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.394 -0.816 . . . . 1.34 109.235 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -62.56 -42.95 99.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.65 -0.657 . . . . 3.65 111.244 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.96 -44.44 94.43 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.557 -0.714 . . . . 2.23 110.722 -178.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.4 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.822 -0.549 . . . . 1.66 110.904 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -65.99 -40.05 90.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.646 -0.659 . . . . 2.58 109.383 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.58 -26.99 67.36 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.841 -0.8 . . . . 1.25 108.841 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 98.3 mttt -86.17 9.13 18.39 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.058 -0.657 . . . . 2.6 110.509 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 84.6 mttt 58.97 19.94 7.68 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.377 -0.827 . . . . 2.74 110.968 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.94 167.58 1.88 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.57 -0.706 . . . . 1.22 109.734 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.61 163.99 36.03 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 O-C-N 123.355 1.187 . . . . 1.03 110.107 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mttp -54.59 -23.55 17.38 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.473 -0.767 . . . . 2.52 109.594 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -56.71 -40.57 75.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.704 -0.623 . . . . 2.22 110.383 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -73.22 -42.27 62.82 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.545 -0.722 . . . . 1.46 111.023 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.5 t -69.94 -54.04 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.538 -0.726 . . . . 1.37 110.963 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -60.21 -41.02 92.13 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.43 -0.794 . . . . 1.33 112.101 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.95 75.41 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.241 -0.912 . . . . 1.18 110.9 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.43 -41.41 89.23 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 119.938 -0.705 . . . . 1.16 110.192 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -39.03 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.044 -1.095 . . . . 1.28 108.044 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -60.26 -43.74 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.179 -1.045 . . . . 3.33 108.179 177.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -65.81 -45.81 80.96 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.562 -0.903 . . . . 2.22 108.562 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 tp -59.69 -39.95 86.28 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 109.749 -0.463 . . . . 2.11 109.749 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -58.9 -39.99 83.13 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.369 -0.832 . . . . 1.95 109.512 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -61.53 -41.53 97.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 1.65 109.137 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.417 ' HB3' ' CG1' ' A' ' 9' ' ' VAL . 71.6 mt -62.57 -49.93 73.33 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.818 -0.808 . . . . 1.34 108.818 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -60.06 -40.02 88.03 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.56 0.695 . . . . 2.84 109.231 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.7 -44.27 96.78 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.951 -0.468 . . . . 1.33 110.649 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.01 -47.17 86.95 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.248 -0.907 . . . . 1.9 109.594 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -42.74 94.79 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.918 0.866 . . . . 2.85 109.466 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -60.62 -40.03 90.4 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.942 -0.572 . . . . 2.56 112.137 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.44 -39.95 85.22 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.288 -0.882 . . . . 2.41 111.595 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -61.53 -51.26 69.32 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.291 -0.881 . . . . 2.82 111.462 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.4 m -157.91 16.13 0.23 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.27 -0.894 . . . . 2.76 112.093 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.03 37.74 73.67 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.074 -1.21 . . . . 1.91 110.074 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.47 ' O ' ' O ' ' A' ' 50' ' ' GLU . 97.9 mt-30 -84.73 -24.06 29.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.487 -1.008 . . . . 3.05 110.714 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 49' ' ' GLN . 13.3 pt-20 40.91 175.18 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.628 0 CA-C-O 122.57 1.176 . . . . 2.37 113.924 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.418 ' CD1' HG21 ' A' ' 9' ' ' VAL . 16.6 t80 . . . . . 0 N--CA 1.5 2.054 0 O-C-N 121.149 -0.969 . . . . 3.0 110.982 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 120.691 0.281 . . . . 2.22 110.736 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.7 m -55.62 -42.07 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.349 -0.845 . . . . 2.11 110.385 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.458 ' CB ' ' CE2' ' A' ' 43' ' ' TYR . 68.6 mt -60.47 -41.43 94.18 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.499 -0.751 . . . . 2.46 109.603 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -42.8 78.51 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.8 -0.563 . . . . 4.15 110.129 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -59.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.574 -0.704 . . . . 2.09 111.509 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -60.08 -56.32 23.05 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.178 -0.951 . . . . 3.44 110.378 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.444 ' CG2' ' CD1' ' A' ' 51' ' ' TYR . 8.6 p -69.32 -38.03 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.401 -0.812 . . . . 1.77 110.128 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -46.43 89.49 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.57 -0.706 . . . . 0.99 111.557 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.6 t -59.98 -47.96 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.548 -0.72 . . . . 1.59 110.383 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.359 -0.838 . . . . 2.4 109.97 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -42.6 -48.53 5.93 Favored Glycine 0 N--CA 1.508 3.48 0 N-CA-C 110.181 -1.168 . . . . 0.41 110.181 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -62.89 -37.36 86.63 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.999 -0.707 . . . . 1.12 111.464 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -39.24 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.156 -0.965 . . . . 1.2 109.702 -179.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.97 -44.8 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 N-CA-C 108.924 -0.769 . . . . 1.34 108.924 178.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -59.99 -41.6 92.38 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 3.65 109.868 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.04 -40.1 95.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 2.23 111.18 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.08 -40.0 92.06 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.411 -0.806 . . . . 1.66 110.86 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -65.69 -42.31 91.35 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.504 -0.747 . . . . 2.58 109.028 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.82 64.38 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.767 -0.827 . . . . 1.25 108.767 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 5.7 mtpp -85.95 8.62 19.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.683 -0.636 . . . . 2.6 110.721 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 27.4 mtpp 59.3 20.09 8.27 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.272 -0.892 . . . . 2.74 111.144 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.99 161.76 8.38 Favored Pre-proline 0 N--CA 1.498 1.945 0 O-C-N 121.506 -0.746 . . . . 1.22 110.137 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.39 165.26 32.26 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.485 1.255 . . . . 1.03 110.912 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -57.0 -31.7 65.36 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.672 -0.642 . . . . 2.52 110.673 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.64 -40.02 82.23 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.571 -0.705 . . . . 2.22 110.507 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -70.13 -41.45 73.89 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.637 -0.664 . . . . 1.46 110.77 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 99.8 t -66.93 -51.27 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.566 -0.709 . . . . 1.37 109.751 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -60.02 -45.6 92.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.758 -0.589 . . . . 1.33 110.758 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.46 75.39 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.311 -0.868 . . . . 1.18 110.36 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.34 -43.5 97.56 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.139 -0.624 . . . . 1.16 110.628 -179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.63 -37.34 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 119.456 -0.898 . . . . 1.28 108.839 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 tppt? -59.97 -39.2 84.83 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.778 0.799 . . . . 3.33 109.207 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -60.0 -45.67 91.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.924 -0.485 . . . . 2.22 110.703 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.06 -35.29 74.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.298 -0.876 . . . . 2.11 110.344 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mp -58.66 -39.77 81.59 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.234 -0.916 . . . . 1.95 109.643 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.6 p -60.01 -40.01 87.81 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 109.095 -0.705 . . . . 1.65 109.095 179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.5 mt -65.16 -47.66 76.27 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.986 -0.746 . . . . 1.34 108.986 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -61.39 -31.57 71.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.148 -0.686 . . . . 2.84 109.148 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.84 -41.5 91.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.698 -0.626 . . . . 1.33 109.419 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.87 -48.64 79.6 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 119.79 -0.764 . . . . 1.9 109.208 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.458 ' CE2' ' CB ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -61.06 -38.51 86.46 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.917 0.865 . . . . 2.85 108.772 178.076 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -60.55 -27.31 67.56 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 116.085 -0.507 . . . . 2.56 111.308 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -55.02 -39.85 69.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.252 -0.905 . . . . 2.41 110.929 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -64.63 -59.85 3.8 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.549 -0.861 . . . . 2.82 110.356 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -165.55 28.89 0.05 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.296 -0.878 . . . . 2.76 111.637 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.98 73.38 0.69 Allowed Glycine 0 N--CA 1.497 2.765 0 N-CA-C 108.994 -1.643 . . . . 1.91 108.994 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.44 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 28.9 mm100 -87.02 -16.42 35.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.634 -0.921 . . . . 3.05 111.984 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 30.26 100.22 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 113.267 0.84 . . . . 2.37 113.267 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.444 ' CD1' ' CG2' ' A' ' 9' ' ' VAL . 32.6 p90 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.125 -0.984 . . . . 3.0 111.492 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp . . . . . 0 N--CA 1.498 1.962 0 CA-C-O 121.525 0.678 . . . . 2.22 109.363 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.5 t -55.42 -44.07 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 N-CA-C 109.348 -0.612 . . . . 2.11 109.348 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.39 -40.5 94.56 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.782 -0.574 . . . . 2.46 110.662 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -59.75 -40.05 86.82 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.498 -0.751 . . . . 4.15 110.463 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -60.16 -40.21 89.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.574 -0.704 . . . . 2.09 110.324 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.92 -49.76 76.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.485 -0.759 . . . . 3.44 111.232 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.413 HG23 ' N ' ' A' ' 10' ' ' ALA . 26.9 m -65.21 -39.95 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 1.77 109.61 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.413 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.57 -38.34 84.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.465 -0.772 . . . . 0.99 110.736 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 72.7 t -60.1 -50.13 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.642 -0.661 . . . . 1.59 110.7 -177.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 -61.87 -50.93 70.25 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.011 -1.056 . . . . 2.4 109.818 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.58 -49.93 4.84 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.974 -1.25 . . . . 0.41 109.974 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.39 -36.8 85.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 122.07 -0.665 . . . . 1.12 111.342 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 68.3 t -59.66 -41.07 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.188 -0.945 . . . . 1.2 109.726 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -59.94 -48.09 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.265 -0.897 . . . . 1.34 108.944 178.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -60.05 -47.6 85.17 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.656 -0.652 . . . . 3.65 110.337 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -62.47 -42.55 99.56 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.589 -0.694 . . . . 2.23 111.192 -178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.7 -40.25 96.32 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.317 -0.865 . . . . 1.66 111.039 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -66.33 -40.23 89.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.637 -0.665 . . . . 2.58 109.882 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -28.12 68.12 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.474 -0.936 . . . . 1.25 108.474 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 62.7 mtpt -84.08 8.77 14.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.854 -0.529 . . . . 2.6 111.002 178.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 95.3 mttt 57.61 27.57 14.4 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 2.74 111.094 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.18 163.43 3.19 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.739 -0.601 . . . . 1.22 110.706 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.9 166.17 27.37 Favored 'Trans proline' 0 C--N 1.315 -1.217 0 O-C-N 123.592 1.312 . . . . 1.03 110.081 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -58.52 -34.33 70.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.671 -0.643 . . . . 2.52 110.811 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.65 -39.79 74.31 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.583 -0.698 . . . . 2.22 110.419 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.86 -46.57 57.47 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.658 -0.651 . . . . 1.46 111.326 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.3 t -69.41 -50.05 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.251 -0.906 . . . . 1.37 111.134 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -59.91 -49.11 78.98 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.454 -0.779 . . . . 1.33 111.277 -178.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.0 -46.21 91.68 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.506 -0.747 . . . . 1.18 110.766 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.31 80.5 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 119.867 -0.733 . . . . 1.16 110.159 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -39.63 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.19 -1.041 . . . . 1.28 108.19 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -61.52 -41.64 97.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.105 -1.072 . . . . 3.33 108.105 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -65.84 -42.84 90.0 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.539 -0.912 . . . . 2.22 108.539 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.04 -40.81 90.66 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 115.952 -0.567 . . . . 2.11 109.719 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 74.4 mt -59.99 -39.71 86.66 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.611 -0.68 . . . . 1.95 109.754 179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.6 t -59.87 -36.62 77.27 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 1.65 109.521 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.3 mt -60.05 -51.09 71.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.611 -0.681 . . . . 1.34 110.117 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -60.98 -39.33 89.22 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.527 -0.733 . . . . 2.84 109.627 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.55 91.87 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.766 -0.584 . . . . 1.33 110.487 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -60.79 -49.45 77.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.306 -0.871 . . . . 1.9 109.591 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.37 -38.26 86.36 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.688 -0.632 . . . . 2.85 110.092 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -59.89 -37.78 80.36 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.72 -0.613 . . . . 2.56 110.771 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -57.98 -39.46 78.23 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.423 -0.798 . . . . 2.41 111.25 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -61.21 -54.33 45.57 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.12 -0.988 . . . . 2.82 111.229 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.4 m -156.61 16.47 0.31 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.256 -0.902 . . . . 2.76 111.433 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.74 29.97 68.89 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.48 -1.048 . . . . 1.91 110.48 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' GLU . 91.5 mm-40 -83.95 -23.83 30.94 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.32 -1.106 . . . . 3.05 110.866 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.427 ' O ' ' O ' ' A' ' 49' ' ' GLN . 8.5 pt-20 40.64 -175.1 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 121.805 0.812 . . . . 2.37 112.855 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.1 t80 . . . . . 0 N--CA 1.5 2.059 0 O-C-N 121.152 -0.968 . . . . 3.0 110.595 -178.961 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 N--CA 1.499 2.021 0 CA-C-O 121.464 0.649 . . . . 2.22 110.436 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -60.01 -48.94 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 2.11 110.608 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -45.02 94.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.297 -0.877 . . . . 2.46 110.604 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -59.95 -43.5 94.97 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.419 -0.801 . . . . 4.15 110.361 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -60.01 -40.26 88.65 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.516 -0.74 . . . . 2.09 110.736 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -60.01 -50.02 75.37 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.522 -0.736 . . . . 3.44 110.611 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.434 HG21 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -69.72 -40.05 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.12 -0.987 . . . . 1.77 109.253 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.434 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -61.77 -49.99 74.17 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 112.832 0.679 . . . . 0.99 112.832 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.4 m -60.08 -49.01 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.229 -0.92 . . . . 1.59 111.968 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -62.94 -42.61 99.86 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.872 -1.143 . . . . 2.4 109.492 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -43.63 -52.6 6.39 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.695 -1.362 . . . . 0.41 109.695 -179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -62.68 -34.76 77.76 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.926 -0.749 . . . . 1.12 111.221 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 92.0 t -59.62 -40.04 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.29 -0.881 . . . . 1.2 109.584 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.419 ' CG1' ' CG2' ' A' ' 33' ' ' VAL . 55.6 t -59.99 -49.97 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 N-CA-C 108.592 -0.892 . . . . 1.34 108.592 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -64.85 -40.93 95.95 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.37 0.605 . . . . 3.65 110.536 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.0 -48.62 80.96 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.73 -0.606 . . . . 2.23 110.775 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 87.1 mt -59.99 -40.51 89.44 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.643 -0.661 . . . . 1.66 110.41 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -69.92 -39.67 76.0 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.618 -0.882 . . . . 2.58 108.618 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.01 -31.72 70.2 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.0 -0.741 . . . . 1.25 109.0 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -92.23 19.4 7.03 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 119.529 -0.869 . . . . 2.6 110.488 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.7 mttm 59.6 20.26 8.83 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.451 -0.78 . . . . 2.74 111.678 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.4 158.7 13.82 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.413 -0.805 . . . . 1.22 109.712 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -73.25 167.23 27.85 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.322 1.169 . . . . 1.03 110.153 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -54.96 -24.56 24.52 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.522 -0.736 . . . . 2.52 109.566 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -57.02 -41.86 79.33 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.728 -0.608 . . . . 2.22 110.209 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -75.44 -48.44 22.76 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.685 -0.634 . . . . 1.46 111.32 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.35 -49.54 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 1.37 109.786 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.95 -40.21 88.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.58 -0.7 . . . . 1.33 110.883 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.78 -51.64 68.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.301 -0.874 . . . . 1.18 110.538 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.14 90.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.629 -0.67 . . . . 1.16 109.296 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.419 ' CG2' ' CG1' ' A' ' 16' ' ' VAL . 9.1 t -64.59 -45.67 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 108.455 -0.943 . . . . 1.28 108.455 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -60.01 -40.95 91.02 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.261 -0.899 . . . . 3.33 108.822 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -65.11 -49.4 70.11 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.466 -0.939 . . . . 2.22 108.466 178.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.0 -39.54 86.12 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 115.821 -0.627 . . . . 2.11 109.689 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.0 mt -58.22 -38.66 77.26 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.419 -0.8 . . . . 1.95 109.608 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.1 t -60.5 -40.7 92.32 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.607 -0.683 . . . . 1.65 109.475 178.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.4 mt -66.8 -50.95 60.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 109.008 -0.738 . . . . 1.34 109.008 179.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -59.99 -39.89 87.32 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.524 0.678 . . . . 2.84 109.274 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.81 80.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.907 -0.496 . . . . 1.33 110.512 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -60.04 -49.95 75.64 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.289 -0.882 . . . . 1.9 110.236 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.37 -39.96 92.55 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.573 -0.705 . . . . 2.85 110.001 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -60.0 -39.35 85.47 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.758 -0.589 . . . . 2.56 110.484 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -58.79 -37.63 76.77 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.549 -0.72 . . . . 2.41 111.12 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -61.26 -54.48 43.49 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.195 -0.941 . . . . 2.82 111.055 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.16 18.21 0.36 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.113 -0.992 . . . . 2.76 111.659 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.97 33.58 70.28 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 110.466 -1.053 . . . . 1.91 110.466 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -86.72 -13.0 46.62 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.33 -1.1 . . . . 3.05 111.628 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 35.92 -156.03 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 N-CA-C 112.807 0.669 . . . . 2.37 112.807 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.6 t80 . . . . . 0 N--CA 1.497 1.905 0 O-C-N 121.17 -0.956 . . . . 3.0 110.552 -179.569 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.9 tt . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 120.797 0.332 . . . . 2.22 110.729 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 p -56.23 -40.88 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 O-C-N 121.272 -0.892 . . . . 2.11 110.461 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -59.79 -40.63 88.99 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.558 -0.714 . . . . 2.46 109.633 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -59.94 -40.12 87.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.611 -0.681 . . . . 4.15 110.016 178.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -61.47 -41.47 97.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.618 -0.676 . . . . 2.09 110.704 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttt85 -59.95 -49.73 76.55 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.541 -0.725 . . . . 3.44 111.101 -178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.43 HG22 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -66.72 -39.83 84.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.437 -0.789 . . . . 1.77 108.93 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.43 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -60.84 -38.57 85.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.797 -0.565 . . . . 0.99 110.97 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.02 -49.95 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.455 -0.778 . . . . 1.59 109.985 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -60.22 -51.91 67.54 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.078 -1.014 . . . . 2.4 109.283 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.01 -58.26 2.34 Favored Glycine 0 N--CA 1.506 3.331 0 N-CA-C 110.68 -0.968 . . . . 0.41 110.68 -178.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.66 -38.52 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.912 -0.758 . . . . 1.12 111.088 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 85.2 t -59.75 -39.96 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.313 -0.867 . . . . 1.2 109.683 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.04 -49.76 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 N-CA-C 108.864 -0.791 . . . . 1.34 108.864 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -59.98 -43.48 95.1 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.72 -0.612 . . . . 3.65 110.103 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.58 -41.55 97.57 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 2.23 111.341 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.35 -42.92 96.76 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.24 -0.913 . . . . 1.66 109.9 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.0 tptp -65.75 -40.0 91.67 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.794 -0.817 . . . . 2.58 108.794 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -26.69 66.72 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.725 -0.842 . . . . 1.25 108.725 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -86.97 10.28 16.85 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.113 -0.635 . . . . 2.6 110.793 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 94.4 mttt 57.35 21.38 6.74 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.294 -0.879 . . . . 2.74 111.091 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.87 162.47 12.22 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.615 -0.678 . . . . 1.22 109.406 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.46 162.69 39.64 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.211 1.111 . . . . 1.03 111.047 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -54.48 -24.45 20.42 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.735 -0.603 . . . . 2.52 110.197 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -59.53 -40.94 88.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.643 -0.661 . . . . 2.22 110.059 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -72.61 -45.61 58.24 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.482 -0.761 . . . . 1.46 110.843 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.1 t -67.02 -50.77 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.553 -0.717 . . . . 1.37 110.305 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -60.13 -43.62 95.54 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.573 -0.705 . . . . 1.33 111.121 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.01 73.47 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.381 -0.824 . . . . 1.18 110.655 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.53 92.59 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 120.261 -0.576 . . . . 1.16 110.492 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -36.57 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.084 -1.08 . . . . 1.28 108.084 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -60.06 -44.13 94.93 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.98 -1.118 . . . . 3.33 107.98 177.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -62.44 -40.03 95.29 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.85 0.833 . . . . 2.22 108.852 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -59.71 -41.5 90.96 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.4 -0.593 . . . . 2.11 109.4 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.4 mt -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.575 -0.703 . . . . 1.95 110.39 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 p -62.12 -27.92 69.27 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.355 -0.841 . . . . 1.65 109.495 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 83.1 mt -66.9 -58.57 4.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.265 -0.897 . . . . 1.34 109.131 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 ptpm? -61.77 -35.53 78.41 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.762 0.791 . . . . 2.84 109.072 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.98 -50.05 75.26 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 116.106 -0.497 . . . . 1.33 109.948 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.34 -40.06 93.16 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.508 -0.745 . . . . 1.9 109.759 179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.432 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -58.98 -39.59 82.22 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.682 -0.636 . . . . 2.85 109.989 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -59.94 -40.04 87.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.604 -0.685 . . . . 2.56 111.046 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.9 -39.25 80.92 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.397 -0.814 . . . . 2.41 111.238 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -64.94 -59.95 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.28 -0.968 . . . . 2.82 110.767 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -159.46 12.52 0.14 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.254 -0.904 . . . . 2.76 112.741 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.84 55.23 20.75 Favored Glycine 0 N--CA 1.498 2.821 0 N-CA-C 109.169 -1.573 . . . . 1.91 109.169 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.432 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 97.1 mt-30 -83.22 -20.49 34.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.579 -0.954 . . . . 3.05 111.61 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 30.28 85.8 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.986 0 N-CA-C 112.892 0.701 . . . . 2.37 112.892 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.1 p90 . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.449 -0.782 . . . . 3.0 111.252 -178.797 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 121.616 0.722 . . . . 2.22 110.114 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 90.5 t -59.22 -40.11 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.836 -0.54 . . . . 2.11 110.425 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.04 -48.8 80.2 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.417 -0.802 . . . . 2.46 110.565 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -59.88 -39.76 86.38 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.519 -0.738 . . . . 4.15 110.796 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -59.91 -39.46 85.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.419 -0.801 . . . . 2.09 110.171 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.1 mmt-85 -59.93 -50.72 72.66 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.502 -0.749 . . . . 3.44 110.342 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.448 ' HB ' ' CE1' ' A' ' 51' ' ' TYR . 35.5 m -67.79 -40.04 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 C-N-CA 119.48 -0.888 . . . . 1.77 109.348 178.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.402 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -59.96 -36.79 77.86 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.571 -0.706 . . . . 0.99 110.278 178.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.486 -0.759 . . . . 1.59 111.305 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -60.0 -52.62 64.62 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.045 -1.034 . . . . 2.4 110.055 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -42.11 -54.85 4.4 Favored Glycine 0 N--CA 1.508 3.485 0 N-CA-C 110.178 -1.169 . . . . 0.41 110.178 -178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -65.61 -38.3 89.05 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.837 -0.802 . . . . 1.12 111.72 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.68 -40.01 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.219 -0.925 . . . . 1.2 109.233 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.3 t -60.0 -49.99 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.398 -0.814 . . . . 1.34 109.368 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -60.0 -43.36 95.23 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.441 -0.787 . . . . 3.65 109.761 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -60.34 -47.61 85.28 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.756 -0.59 . . . . 2.23 110.772 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.96 -44.04 94.67 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.61 -0.682 . . . . 1.66 110.591 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -65.69 -40.3 92.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.521 -0.737 . . . . 2.58 109.146 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.78 -26.54 68.68 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.499 -0.926 . . . . 1.25 108.499 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 45.6 mtpt -87.74 12.01 13.9 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.754 -0.591 . . . . 2.6 110.644 179.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.8 mtmt 59.8 20.8 9.64 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.383 -0.823 . . . . 2.74 111.195 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.87 161.78 6.18 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.461 -0.774 . . . . 1.22 109.663 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.22 162.1 43.55 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.379 1.2 . . . . 1.03 110.333 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -55.64 -27.35 49.28 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.589 -0.694 . . . . 2.52 110.028 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -59.97 -39.95 87.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.73 -0.607 . . . . 2.22 110.294 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -70.53 -43.12 70.24 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.205 -0.934 . . . . 1.46 110.676 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.36 -51.96 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.485 -0.759 . . . . 1.37 110.047 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 1.33 110.879 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.81 -47.48 83.26 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.382 -0.824 . . . . 1.18 110.399 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.95 84.62 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.09 -0.644 . . . . 1.16 110.279 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.66 -35.93 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.304 -0.998 . . . . 1.28 108.304 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -60.08 -42.86 95.49 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.318 -0.993 . . . . 3.33 108.318 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -60.58 -40.0 90.1 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.326 -0.99 . . . . 2.22 108.326 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.85 -44.29 73.84 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.804 -0.634 . . . . 2.11 110.54 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.444 -0.785 . . . . 1.95 109.699 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.0 t -59.87 -32.68 70.94 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.297 -0.631 . . . . 1.65 109.297 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 78.8 mt -65.52 -57.97 6.92 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 120.077 -0.649 . . . . 1.34 109.416 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.02 -33.44 72.0 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.421 -0.799 . . . . 2.84 109.607 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.48 -42.24 91.61 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.267 -0.573 . . . . 1.33 109.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.02 -48.14 82.95 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 107.98 -1.119 . . . . 1.9 107.98 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -60.29 -39.05 85.54 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.723 0.773 . . . . 2.85 109.417 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -60.01 -33.08 71.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.831 -0.543 . . . . 2.56 111.065 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.46 -39.97 71.03 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.463 -0.773 . . . . 2.41 110.14 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.83 -74.93 0.1 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.506 -0.746 . . . . 2.82 109.868 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.3 t -160.05 30.17 0.18 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.473 -0.767 . . . . 2.76 110.241 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.18 68.4 1.65 Allowed Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.517 -1.433 . . . . 1.91 109.517 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -88.41 -26.85 21.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.586 -0.949 . . . . 3.05 111.428 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 31.23 97.56 0.0 OUTLIER 'General case' 0 N--CA 1.519 3.003 0 N-CA-C 112.772 0.656 . . . . 2.37 112.772 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.448 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 46.7 p90 . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.103 -0.998 . . . . 3.0 111.52 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 121.68 0.752 . . . . 2.22 109.467 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.18 -44.47 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.984 -0.448 . . . . 2.11 109.945 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.02 -44.93 94.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.431 -0.793 . . . . 2.46 109.496 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -60.06 -41.65 92.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.743 -0.598 . . . . 4.15 111.27 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -60.04 -40.63 90.07 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.472 -0.768 . . . . 2.09 111.213 -178.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.4 mtp180 -60.03 -50.37 73.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.383 -0.823 . . . . 3.44 110.503 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.427 HG23 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -69.67 -40.03 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.754 -0.832 . . . . 1.77 108.754 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.427 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -59.98 -38.46 82.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.708 -0.62 . . . . 0.99 110.554 179.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.553 -0.717 . . . . 1.59 110.46 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -60.67 -53.58 55.76 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.259 -0.9 . . . . 2.4 109.738 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.32 -55.5 2.48 Favored Glycine 0 N--CA 1.51 3.567 0 N-CA-C 110.632 -0.987 . . . . 0.41 110.632 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -61.95 -38.52 88.8 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.92 -0.753 . . . . 1.12 111.388 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.94 -41.96 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.319 -0.863 . . . . 1.2 109.51 -178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.9 t -60.7 -47.65 92.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 1.34 109.378 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -59.99 -41.14 91.42 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.56 -0.713 . . . . 3.65 110.502 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.95 -40.99 97.69 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.515 -0.74 . . . . 2.23 111.201 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.99 -43.88 94.88 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.347 -0.845 . . . . 1.66 110.656 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -65.15 -39.98 93.72 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.713 -0.847 . . . . 2.58 108.713 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.95 -24.19 66.84 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.71 -0.848 . . . . 1.25 108.71 177.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 87.7 mttt -88.13 10.52 19.04 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 2.6 110.423 178.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.7 mtmt 60.08 19.92 9.14 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.375 -0.828 . . . . 2.74 111.396 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.92 163.42 9.84 Favored Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.562 -0.711 . . . . 1.22 109.968 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.2 160.49 45.16 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.321 1.169 . . . . 1.03 110.392 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -56.91 -29.49 63.08 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.623 -0.673 . . . . 2.52 111.002 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.93 -40.01 75.57 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.36 -0.838 . . . . 2.22 110.688 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -70.51 -43.37 69.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.417 -0.802 . . . . 1.46 110.576 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.7 t -68.41 -47.8 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.637 -0.664 . . . . 1.37 110.648 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -59.97 -44.05 94.68 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.391 -0.818 . . . . 1.33 110.349 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.4 76.2 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.556 -0.715 . . . . 1.18 110.138 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.05 -43.2 96.23 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.647 . . . . 1.16 110.624 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -35.29 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 108.492 -0.929 . . . . 1.28 108.492 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -60.02 -40.04 87.95 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.442 -1.318 . . . . 3.33 107.442 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -60.25 -39.96 88.62 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.209 -1.034 . . . . 2.22 108.209 177.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.98 -45.03 83.24 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 116.033 -0.53 . . . . 2.11 110.173 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -38.34 72.84 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.528 -0.732 . . . . 1.95 109.871 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -61.38 -40.03 92.85 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 109.151 -0.685 . . . . 1.65 109.151 178.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -65.99 -55.16 18.15 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.619 -0.882 . . . . 1.34 108.619 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -60.0 -36.49 77.31 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.363 0.602 . . . . 2.84 109.651 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.72 94.79 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.822 -0.549 . . . . 1.33 110.213 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.97 -48.0 83.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.269 -0.894 . . . . 1.9 109.142 178.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.6 -39.96 90.07 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.623 0.725 . . . . 2.85 109.217 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 88.6 tttt -60.05 -38.33 82.5 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.707 -0.62 . . . . 2.56 110.958 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.29 -39.96 80.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.546 -0.721 . . . . 2.41 112.11 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 mttt -61.08 -53.51 56.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.031 -1.043 . . . . 2.82 110.654 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.3 m -156.76 13.91 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.487 -0.758 . . . . 2.76 112.021 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 70.02 39.41 74.0 Favored Glycine 0 N--CA 1.498 2.814 0 N-CA-C 110.201 -1.16 . . . . 1.91 110.201 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 50' ' ' GLU . 45.4 mt-30 -85.59 -20.13 29.99 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.365 -1.079 . . . . 3.05 111.483 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.535 ' O ' ' O ' ' A' ' 49' ' ' GLN . 15.5 pt-20 42.09 161.92 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.704 1.24 . . . . 2.37 113.853 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.9 t80 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 120.872 -1.142 . . . . 3.0 110.711 -179.246 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.0 tt . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 121.273 0.558 . . . . 2.22 110.685 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.3 p -58.83 -39.4 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.677 -0.639 . . . . 2.11 110.379 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.97 -46.2 88.68 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.733 -0.605 . . . . 2.46 110.426 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -60.0 -40.05 87.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 4.15 110.627 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.4 ' O ' ' CG2' ' A' ' 11' ' ' VAL . 99.5 m-20 -60.22 -40.1 88.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.255 -0.903 . . . . 2.09 110.553 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -60.05 -49.98 75.53 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.452 -0.78 . . . . 3.44 111.083 -179.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.429 HG22 ' N ' ' A' ' 10' ' ' ALA . 32.6 m -67.6 -39.95 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 119.383 -0.927 . . . . 1.77 108.913 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.429 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -61.89 -38.14 87.2 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.708 -0.62 . . . . 0.99 111.276 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.4 ' CG2' ' O ' ' A' ' 7' ' ' ASN . 54.5 t -59.99 -50.02 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.803 . . . . 1.59 110.465 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -60.28 -50.05 75.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.101 -1.04 . . . . 2.4 109.081 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.48 -56.24 3.55 Favored Glycine 0 N--CA 1.509 3.545 0 N-CA-C 110.282 -1.127 . . . . 0.41 110.282 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -61.6 -40.04 93.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.866 -0.785 . . . . 1.12 110.316 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 91.9 t -59.7 -39.26 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.427 -0.796 . . . . 1.2 109.307 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.9 t -59.92 -50.06 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 N-CA-C 108.593 -0.891 . . . . 1.34 108.593 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.1 ttt85 -60.27 -41.42 93.23 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.742 -0.599 . . . . 3.65 110.178 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.6 -39.94 90.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.573 -0.705 . . . . 2.23 110.573 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 86.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.532 -0.73 . . . . 1.66 110.104 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp -69.1 -40.05 78.6 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.574 0.702 . . . . 2.58 109.24 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.08 -33.56 72.24 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.105 -0.702 . . . . 1.25 109.105 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 14.2 ptmt -91.39 17.57 8.31 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.701 -0.8 . . . . 2.6 110.946 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 14.2 mtmt 59.59 22.38 11.04 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.359 -0.838 . . . . 2.74 111.329 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.91 151.55 23.86 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.44 -0.788 . . . . 1.22 110.26 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -69.09 170.71 15.15 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.411 1.216 . . . . 1.03 111.032 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.9 -32.63 67.91 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.195 0.521 . . . . 2.52 110.5 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -59.23 -39.97 84.41 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.6 -0.688 . . . . 2.22 111.169 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -70.16 -40.57 74.66 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.414 -0.804 . . . . 1.46 110.639 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 83.6 t -68.57 -52.17 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.653 -0.654 . . . . 1.37 110.438 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.07 -43.85 95.16 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.59 -0.694 . . . . 1.33 110.716 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.03 -47.49 86.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.448 -0.782 . . . . 1.18 110.377 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.54 -44.75 89.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.599 -0.688 . . . . 1.16 110.365 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -38.21 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 108.143 -1.058 . . . . 1.28 108.143 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -60.0 -42.04 93.39 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.126 -1.064 . . . . 3.33 108.126 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -62.94 -47.16 84.42 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.353 -0.981 . . . . 2.22 108.353 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.5 tp -60.01 -41.31 91.89 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.831 -0.622 . . . . 2.11 109.503 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.19 -38.36 79.64 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.59 -0.694 . . . . 1.95 109.614 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.9 t -60.77 -41.14 94.91 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.089 -0.708 . . . . 1.65 109.089 178.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.4 ' HB3' ' CG1' ' A' ' 9' ' ' VAL . 63.3 mt -63.07 -50.18 71.6 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.467 -0.938 . . . . 1.34 108.467 178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.02 -40.01 87.79 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.653 0.74 . . . . 2.84 109.341 177.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -49.31 78.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.867 -0.521 . . . . 1.33 110.958 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -49.28 78.28 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.215 -0.928 . . . . 1.9 109.979 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.09 -37.01 78.68 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.572 0.701 . . . . 2.85 109.991 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.98 -40.0 87.65 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.681 -0.637 . . . . 2.56 111.297 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.08 -38.25 73.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.464 -0.773 . . . . 2.41 111.257 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.82 -55.17 36.2 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.267 -0.895 . . . . 2.82 110.849 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 29.7 m -158.45 16.85 0.21 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.277 -0.889 . . . . 2.76 111.912 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.87 37.8 75.23 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.433 -1.467 . . . . 1.91 109.433 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' O ' ' A' ' 50' ' ' GLU . 14.3 mm100 -81.5 -29.27 33.69 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.62 -0.93 . . . . 3.05 110.795 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 49' ' ' GLN . 8.5 pt-20 40.56 -172.47 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.505 0.669 . . . . 2.37 112.543 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.0 t80 . . . . . 0 N--CA 1.498 1.972 0 O-C-N 121.169 -0.957 . . . . 3.0 110.857 -179.284 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.1 tp . . . . . 0 N--CA 1.501 2.083 0 CA-C-O 121.084 0.469 . . . . 2.22 111.57 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.5 p -59.02 -41.96 84.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.549 -0.719 . . . . 2.11 110.861 -178.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.97 -40.6 89.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.598 -0.689 . . . . 2.46 109.936 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.02 -40.0 87.8 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.479 -0.763 . . . . 4.15 109.883 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -59.97 -40.0 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.476 -0.765 . . . . 2.09 109.804 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -60.03 -50.43 73.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.585 -0.697 . . . . 3.44 111.269 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.0 m -70.02 -40.9 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.225 -0.922 . . . . 1.77 109.575 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.13 -44.69 96.94 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.612 -0.68 . . . . 0.99 111.227 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.3 t -60.06 -46.7 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.384 -0.823 . . . . 1.59 110.362 -178.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -60.03 -49.13 78.88 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.118 -0.989 . . . . 2.4 109.347 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.47 -48.87 3.02 Favored Glycine 0 N--CA 1.51 3.631 0 N-CA-C 110.18 -1.168 . . . . 0.41 110.18 -179.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.38 -34.38 78.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.879 -0.777 . . . . 1.12 110.873 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.71 -43.66 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.284 -0.885 . . . . 1.2 109.264 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.47 -45.51 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 N-CA-C 107.911 -1.144 . . . . 1.34 107.911 177.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -60.32 -40.02 89.11 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 116.04 -0.527 . . . . 3.65 110.879 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.97 -42.5 94.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.48 -0.763 . . . . 2.23 109.93 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.4 -40.18 90.0 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.493 0.663 . . . . 1.66 110.612 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -68.67 -39.99 80.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.392 -0.818 . . . . 2.58 109.052 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -30.86 69.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.073 -0.714 . . . . 1.25 109.073 178.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 17.7 ptpt -94.31 19.33 9.62 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.771 -0.771 . . . . 2.6 110.773 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 2.3 mtpm? 56.9 24.47 9.36 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.423 -0.798 . . . . 2.74 111.082 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.86 59.62 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.66 -0.65 . . . . 1.22 110.369 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.71 159.38 51.44 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.473 1.249 . . . . 1.03 110.684 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -55.17 -27.53 46.34 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.672 -0.642 . . . . 2.52 109.611 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -59.32 -40.12 85.26 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.787 -0.571 . . . . 2.22 110.047 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -70.73 -45.52 64.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.535 -0.728 . . . . 1.46 110.006 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 66.9 t -67.31 -40.49 84.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.737 -0.602 . . . . 1.37 109.801 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -60.07 -49.01 79.34 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.596 -0.69 . . . . 1.33 110.943 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.19 91.14 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.191 -0.943 . . . . 1.18 110.562 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.27 89.02 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 1.16 110.837 -179.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.402 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -66.25 -39.49 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.239 -0.913 . . . . 1.28 108.646 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -60.2 -40.88 91.62 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.173 -1.047 . . . . 3.33 108.173 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -65.72 -44.68 85.3 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.126 -1.064 . . . . 2.22 108.126 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.402 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 14.4 tp -59.06 -48.86 80.07 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 115.54 -0.754 . . . . 2.11 110.176 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -58.4 -37.46 75.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.318 -0.864 . . . . 1.95 109.657 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -59.97 -36.76 77.83 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.545 -0.722 . . . . 1.65 109.339 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.0 mt -59.95 -41.49 91.99 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.505 -0.747 . . . . 1.34 109.283 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 98.3 mttt -62.7 -40.44 97.13 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 120.149 -0.62 . . . . 2.84 109.511 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -40.61 89.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.79 -0.569 . . . . 1.33 110.498 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -60.15 -48.7 80.64 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.517 -0.739 . . . . 1.9 109.639 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -60.04 -40.44 89.39 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 2.85 110.031 179.142 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.428 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 97.9 mttt -62.71 -23.85 67.36 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.725 -0.609 . . . . 2.56 111.979 -179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.07 -39.97 79.87 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.272 -0.893 . . . . 2.41 111.014 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -64.26 -56.14 16.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.538 -0.726 . . . . 2.82 110.657 -179.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -163.21 27.28 0.09 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.461 -0.774 . . . . 2.76 110.804 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.428 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 71.62 41.1 57.92 Favored Glycine 0 N--CA 1.497 2.737 0 C-N-CA 120.012 -1.09 . . . . 1.91 110.387 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.412 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 70.7 mt-30 -83.45 -23.01 32.44 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.31 -1.112 . . . . 3.05 110.897 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 36.7 -157.55 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 112.602 0.593 . . . . 2.37 112.602 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.8 t80 . . . . . 0 N--CA 1.5 2.027 0 O-C-N 121.364 -0.835 . . . . 3.0 110.46 -179.447 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.5 tt . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 121.567 0.699 . . . . 2.22 110.005 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 70.0 t -58.8 -49.29 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.864 -0.523 . . . . 2.11 110.062 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.99 -39.99 87.62 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.658 . . . . 2.46 110.625 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -58.68 -40.98 85.14 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.44 -0.787 . . . . 4.15 110.59 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -60.44 -40.38 90.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.612 -0.68 . . . . 2.09 111.421 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -59.97 -53.05 62.42 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.284 -0.885 . . . . 3.44 110.738 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.443 ' HB ' ' CE1' ' A' ' 51' ' ' TYR . 28.8 m -69.87 -40.06 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.587 -0.696 . . . . 1.77 109.763 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.15 -43.58 95.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.757 -0.589 . . . . 0.99 111.464 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.4 t -59.96 -49.23 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.422 -0.799 . . . . 1.59 110.406 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -59.98 -50.14 74.92 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.023 -1.048 . . . . 2.4 109.47 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -38.77 -49.47 2.51 Favored Glycine 0 N--CA 1.509 3.521 0 N-CA-C 110.654 -0.978 . . . . 0.41 110.654 -178.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -64.53 -37.6 88.12 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.868 -0.783 . . . . 1.12 110.979 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.94 -40.06 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.407 -0.808 . . . . 1.2 109.815 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 83.1 t -59.92 -50.34 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.938 . . . . 1.34 108.826 178.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -62.53 -40.01 95.41 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.553 0.692 . . . . 3.65 109.783 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.0 tp10 -59.95 -42.44 94.04 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.863 -0.523 . . . . 2.23 111.341 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.95 -44.88 94.12 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.777 0.799 . . . . 1.66 109.928 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -69.97 -37.49 75.81 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.497 -0.927 . . . . 2.58 108.497 178.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.48 70.9 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.708 -0.849 . . . . 1.25 108.708 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 43.8 pttt -93.91 20.93 7.14 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 119.552 -0.859 . . . . 2.6 110.611 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 49.0 mtmt 60.05 20.38 9.54 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.532 -0.73 . . . . 2.74 111.926 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.19 163.06 4.91 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.424 -0.798 . . . . 1.22 110.614 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -76.77 166.52 26.89 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.449 1.236 . . . . 1.03 111.128 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -58.21 -28.27 64.67 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.736 -0.603 . . . . 2.52 111.316 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -57.67 -40.07 78.54 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.143 -0.973 . . . . 2.22 110.423 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -71.84 -39.98 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.68 0.752 . . . . 1.46 109.52 178.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.1 t -66.95 -53.36 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-N 116.224 -0.444 . . . . 1.37 110.439 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -59.95 -48.0 83.5 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.567 -0.708 . . . . 1.33 111.269 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.98 83.64 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.298 -0.877 . . . . 1.18 110.519 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.43 -40.01 89.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.647 -0.658 . . . . 1.16 110.554 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -40.04 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.489 -0.884 . . . . 1.28 108.73 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.15 -40.29 93.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.046 -1.062 . . . . 3.33 108.364 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -66.12 -47.16 75.06 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.806 -0.812 . . . . 2.22 108.806 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 tp -60.06 -43.73 95.22 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.95 -0.469 . . . . 2.11 110.062 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.1 mt -59.98 -39.13 84.61 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.489 -0.757 . . . . 1.95 109.714 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.6 m -60.0 -39.53 86.09 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.271 -0.641 . . . . 1.65 109.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.9 mt -60.21 -55.45 33.58 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.435 -0.79 . . . . 1.34 109.91 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.91 -38.56 86.15 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.482 -0.762 . . . . 2.84 109.65 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.65 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 120.433 -0.507 . . . . 1.33 110.592 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.13 -50.95 71.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.124 -0.985 . . . . 1.9 109.792 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.437 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -63.54 -39.2 93.8 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.749 0.785 . . . . 2.85 109.801 178.776 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -60.01 -39.29 85.32 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.872 -0.518 . . . . 2.56 111.013 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -55.44 -37.77 68.15 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.422 -0.799 . . . . 2.41 111.023 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -63.07 -56.4 17.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.253 -0.905 . . . . 2.82 111.322 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.5 m -157.14 18.14 0.29 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.295 -0.878 . . . . 2.76 111.848 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.76 52.25 30.53 Favored Glycine 0 N--CA 1.496 2.655 0 N-CA-C 108.679 -1.769 . . . . 1.91 108.679 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.437 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 90.3 mm-40 -76.63 -37.64 56.01 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.888 . . . . 3.05 111.472 -178.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 32.7 96.83 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.963 0 N-CA-C 112.711 0.634 . . . . 2.37 112.711 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.443 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 41.0 p90 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 120.911 -1.118 . . . . 3.0 110.467 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.216 0.531 . . . . 3.98 110.481 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.0 p -65.45 -25.75 67.65 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.708 -0.62 . . . . 2.33 110.26 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -39.99 95.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.52 -0.738 . . . . 2.22 110.534 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.97 -49.93 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.327 -0.858 . . . . 2.11 109.626 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -60.0 -33.3 71.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.468 -0.77 . . . . 2.46 109.214 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -48.61 79.61 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.473 0.654 . . . . 4.15 110.069 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -61.78 -40.04 93.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.724 -0.61 . . . . 2.09 112.017 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.7 ttt180 -59.98 -51.69 68.6 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.26 -0.9 . . . . 3.44 111.7 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.401 HG11 ' N ' ' A' ' 10' ' ' ALA . 11.5 p -66.87 -40.0 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.126 -0.984 . . . . 1.77 109.389 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.401 ' N ' HG11 ' A' ' 9' ' ' VAL . . . -59.94 -40.92 90.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.737 -0.602 . . . . 0.99 111.081 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.28 -50.02 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.464 -0.772 . . . . 1.59 110.644 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -62.85 -51.79 65.65 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.17 -0.957 . . . . 2.4 109.739 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.1 -51.6 2.73 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.593 -1.003 . . . . 0.41 110.593 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -64.55 -39.02 92.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.899 -0.765 . . . . 1.12 111.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 75.8 t -59.79 -42.75 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.345 -0.847 . . . . 1.2 109.693 -178.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.01 -48.98 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 1.34 109.819 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.0 -42.31 94.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.719 -0.613 . . . . 3.65 110.622 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -61.26 -48.26 82.27 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.605 -0.685 . . . . 2.23 111.244 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.2 mt -60.0 -42.11 93.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.675 -0.64 . . . . 1.66 111.298 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -63.99 -40.02 95.42 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.479 -0.934 . . . . 2.58 108.479 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.48 67.71 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.607 -0.886 . . . . 1.25 108.607 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 36.1 mtpt -85.08 8.92 16.29 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.741 -0.599 . . . . 2.6 110.986 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 55.7 mtmt 58.64 21.54 8.87 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.204 -0.935 . . . . 2.74 110.894 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.66 166.46 1.8 Allowed Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.562 -0.711 . . . . 1.22 110.418 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.76 161.26 46.19 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.436 1.23 . . . . 1.03 110.207 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -56.84 -29.53 62.92 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.557 -0.715 . . . . 2.52 110.63 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.66 -39.88 85.9 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.533 -0.73 . . . . 2.22 110.988 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.07 -44.57 68.86 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 1.46 110.589 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 96.9 t -68.6 -48.56 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.713 -0.617 . . . . 1.37 110.256 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -60.04 -49.49 77.45 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.509 -0.744 . . . . 1.33 111.503 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.77 84.21 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.14 -0.975 . . . . 1.18 110.427 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.13 96.13 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 120.296 -0.561 . . . . 1.16 110.803 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.07 -37.13 79.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.257 -1.016 . . . . 1.28 108.257 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.24 -40.08 88.99 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.924 -0.769 . . . . 3.33 108.924 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.37 -50.68 72.64 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.883 -0.511 . . . . 2.22 110.219 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.21 -38.42 83.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.605 -0.684 . . . . 2.11 109.669 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.7 mt -58.0 -41.31 82.79 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.541 -0.724 . . . . 1.95 109.986 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.8 m -60.27 -39.98 88.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.577 -0.702 . . . . 1.65 109.326 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.2 mt -67.82 -43.21 80.12 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.007 -0.677 . . . . 1.34 109.279 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.01 -39.19 84.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.74 -0.6 . . . . 2.84 109.921 178.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -42.16 91.93 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.262 -0.575 . . . . 1.33 110.453 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.14 -41.39 98.22 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.332 -0.855 . . . . 1.9 109.875 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -40.46 89.58 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.953 0.882 . . . . 2.85 109.541 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -60.03 -34.17 73.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.905 -0.497 . . . . 2.56 111.177 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -56.1 -40.01 73.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.563 -0.711 . . . . 2.41 111.834 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -62.2 -57.83 10.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.085 -1.009 . . . . 2.82 111.329 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.3 m -156.21 25.16 0.36 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.135 -0.978 . . . . 2.76 111.155 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.95 36.27 64.95 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.607 -0.997 . . . . 1.91 110.607 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -85.18 -15.85 42.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.402 -1.058 . . . . 3.05 111.43 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 38.05 -166.37 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.009 0.744 . . . . 2.37 113.009 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -71.83 105.09 3.66 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.184 -0.948 . . . . 3.0 110.207 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.7 mmtm -69.13 136.93 89.27 Favored Pre-proline 0 N--CA 1.493 1.697 0 N-CA-C 108.624 -0.88 . . . . 5.37 108.624 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -71.35 -177.47 2.41 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 O-C-N 123.159 1.084 . . . . 3.88 111.102 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.7 16.25 77.87 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 111.206 -0.758 . . . . 3.24 111.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 54.25 177.71 0.03 OUTLIER Pre-proline 0 N--CA 1.505 2.306 0 O-C-N 121.005 -1.291 . . . . 4.41 110.657 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.99 150.02 66.22 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.107 1.056 . . . . 4.33 110.463 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.318 -1.041 0 O-C-N 123.582 1.306 . . . . 4.82 110.829 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 46.0 t0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.878 0.371 . . . . 3.98 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.7 m -71.33 60.8 0.31 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.478 -0.764 . . . . 2.33 110.346 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tp -66.43 -40.0 89.25 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.563 -0.711 . . . . 2.22 110.393 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 86.9 t -59.95 -45.53 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.68 -0.638 . . . . 2.11 110.655 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 86.9 mt -59.96 -39.95 87.35 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.374 -0.829 . . . . 2.46 109.868 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -57.63 -38.54 75.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.685 -0.634 . . . . 4.15 109.947 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -60.05 -40.02 88.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.585 -0.697 . . . . 2.09 110.315 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 mtp85 -59.97 -50.99 71.59 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.373 -0.83 . . . . 3.44 110.886 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.403 HG21 ' N ' ' A' ' 10' ' ' ALA . 25.1 m -69.54 -38.09 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 108.238 -1.023 . . . . 1.77 108.238 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.403 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -60.07 -39.33 85.66 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 116.098 -0.501 . . . . 0.99 110.543 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.03 -50.02 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.378 -0.826 . . . . 1.59 109.96 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.44 -50.22 74.45 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.151 -0.968 . . . . 2.4 109.392 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.67 -55.49 3.23 Favored Glycine 0 N--CA 1.507 3.388 0 N-CA-C 110.143 -1.183 . . . . 0.41 110.143 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -65.0 -35.61 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.934 -0.745 . . . . 1.12 110.854 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 86.0 t -60.01 -40.0 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 121.263 -0.898 . . . . 1.2 109.666 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.02 -49.0 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 N-CA-C 108.902 -0.777 . . . . 1.34 108.902 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.8 ttp85 -60.32 -43.12 96.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.866 -0.521 . . . . 3.65 110.444 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.99 -41.7 97.42 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.41 -0.806 . . . . 2.23 111.406 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.76 -40.51 92.74 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.42 -0.8 . . . . 1.66 110.424 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.7 tptt -67.2 -40.09 86.43 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.127 -0.694 . . . . 2.58 109.127 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.46 -26.26 66.63 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.739 -0.837 . . . . 1.25 108.739 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -86.22 9.18 18.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.725 -0.609 . . . . 2.6 110.391 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 56.7 21.37 5.83 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.279 -0.888 . . . . 2.74 111.073 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.24 163.56 5.99 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.586 -0.696 . . . . 1.22 109.933 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.82 162.32 40.08 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 O-C-N 123.484 1.255 . . . . 1.03 111.292 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -55.28 -27.4 46.42 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.754 -0.591 . . . . 2.52 110.258 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -58.66 -40.0 82.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.62 -0.675 . . . . 2.22 110.461 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -71.15 -45.35 63.71 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -0.81 . . . . 1.46 110.869 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 82.5 t -68.55 -50.0 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.497 -0.752 . . . . 1.37 110.164 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -59.98 -46.16 90.34 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 1.33 110.871 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.39 82.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.255 -0.903 . . . . 1.18 110.404 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.15 -42.26 89.28 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 120.086 -0.645 . . . . 1.16 110.496 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.431 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -65.93 -39.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 N-CA-C 108.358 -0.978 . . . . 1.28 108.358 179.331 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -61.06 -42.28 98.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.997 -1.112 . . . . 3.33 107.997 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -65.32 -42.45 92.98 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.833 -1.173 . . . . 2.22 107.833 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.431 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 15.4 tp -60.03 -46.63 88.89 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.737 -0.665 . . . . 2.11 110.0 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.42 -38.4 80.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.272 -0.892 . . . . 1.95 109.575 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 t -59.74 -34.51 73.04 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.644 . . . . 1.65 109.633 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.0 mt -60.0 -48.91 79.76 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.473 -0.767 . . . . 1.34 109.5 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.93 -39.93 91.28 Favored 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.774 0.797 . . . . 2.84 109.109 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -43.97 94.85 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 116.177 -0.465 . . . . 1.33 110.566 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.97 -50.68 72.81 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.302 -0.874 . . . . 1.9 109.655 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.404 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -64.47 -38.28 90.46 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.814 0.816 . . . . 2.85 109.718 178.591 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.9 tttp -60.0 -39.05 84.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.928 -0.483 . . . . 2.56 111.815 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -54.86 -39.03 68.21 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.386 -0.821 . . . . 2.41 112.003 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -62.58 -60.01 4.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.009 -1.057 . . . . 2.82 111.325 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.9 m -156.26 23.47 0.36 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.287 -0.883 . . . . 2.76 110.876 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.04 63.11 3.6 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 109.385 -1.486 . . . . 1.91 109.385 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.404 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 95.7 mm-40 -83.82 -41.5 17.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.495 -1.003 . . . . 3.05 111.823 -179.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 8.0 pt-20 33.54 92.14 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.86 0 CA-C-O 121.584 0.706 . . . . 2.37 112.113 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -51.04 154.1 1.65 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.107 -0.995 . . . . 3.0 111.248 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.02 153.99 52.45 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.603 -0.686 . . . . 5.37 110.465 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -74.26 -17.13 21.83 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.393 1.207 . . . . 3.88 111.717 -178.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.85 33.01 3.6 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.825 -1.179 . . . . 3.24 112.056 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 54.62 177.35 0.03 OUTLIER Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 120.901 -1.352 . . . . 4.41 110.868 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.96 150.04 66.42 Favored 'Trans proline' 0 N--CA 1.487 1.14 0 O-C-N 123.408 1.215 . . . . 4.33 111.193 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.319 -1.013 0 O-C-N 123.586 1.309 . . . . 4.82 110.285 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.464 -0.569 . . . . 3.98 109.464 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.1 m -71.42 58.49 0.27 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.448 -0.782 . . . . 2.33 110.302 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.13 -41.32 94.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.452 -0.78 . . . . 2.22 109.113 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.9 p -58.02 -40.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 121.354 0.597 . . . . 2.11 110.531 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.0 tt -60.02 -40.72 90.28 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.373 0.606 . . . . 2.46 110.183 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.407 ' O ' HG21 ' A' ' 9' ' ' VAL . 64.7 t80 -59.52 -40.11 86.09 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.888 -0.508 . . . . 4.15 110.369 -178.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -63.21 -40.41 97.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 2.09 110.259 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -62.42 -49.63 74.71 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.13 -0.981 . . . . 3.44 112.106 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.407 HG21 ' O ' ' A' ' 6' ' ' TYR . 26.6 m -64.83 -42.81 95.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.02 -1.05 . . . . 1.77 110.654 -179.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.24 -40.76 97.24 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.39 -0.819 . . . . 0.99 111.689 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.5 t -60.09 -47.68 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.454 -0.779 . . . . 1.59 111.132 -177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -60.61 -48.17 82.95 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 119.245 -0.982 . . . . 2.4 109.553 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -38.6 -56.81 1.97 Allowed Glycine 0 N--CA 1.511 3.688 0 N-CA-C 110.175 -1.17 . . . . 0.41 110.175 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.58 -38.49 91.33 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.977 -0.719 . . . . 1.12 111.004 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.1 t -59.87 -44.4 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.816 . . . . 1.2 109.427 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 63.9 t -59.98 -44.99 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 108.386 -0.968 . . . . 1.34 108.386 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -60.45 -41.57 94.35 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.875 -0.515 . . . . 3.65 111.069 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -64.16 -44.51 91.86 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.345 -0.847 . . . . 2.23 111.445 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.32 -41.96 97.88 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.536 -0.727 . . . . 1.66 111.097 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.3 tptt -63.93 -40.02 95.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.361 -0.837 . . . . 2.58 108.993 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.8 67.22 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.58 -0.896 . . . . 1.25 108.58 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 66.0 mttm -84.37 7.38 19.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.729 -0.607 . . . . 2.6 110.852 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 25.9 mmtp 59.28 20.14 8.29 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.172 -0.955 . . . . 2.74 110.938 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.76 162.3 9.6 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.613 -0.68 . . . . 1.22 109.822 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.2 166.48 28.0 Favored 'Trans proline' 0 C--N 1.314 -1.237 0 O-C-N 123.33 1.174 . . . . 1.03 111.133 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.1 -26.87 51.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.747 -0.596 . . . . 2.52 111.005 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.6 -40.04 86.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.478 -0.763 . . . . 2.22 110.557 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.45 -45.93 57.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 1.46 110.933 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 88.8 t -63.89 -49.89 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.498 -0.751 . . . . 1.37 109.461 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -60.0 -44.92 94.24 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.742 -0.599 . . . . 1.33 111.025 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -50.03 75.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.405 -0.809 . . . . 1.18 110.564 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.38 -45.92 88.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.659 -0.651 . . . . 1.16 110.21 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -35.63 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.28 -1.007 . . . . 1.28 108.28 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -59.94 -43.93 94.68 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.45 -0.944 . . . . 3.33 108.45 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? -64.37 -47.44 79.28 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.356 -0.979 . . . . 2.22 108.356 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 tp -59.95 -40.4 88.87 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 115.613 -0.722 . . . . 2.11 110.032 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.6 mt -59.56 -37.41 78.4 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.538 -0.726 . . . . 1.95 109.919 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.7 m -59.84 -40.11 87.42 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.556 -0.715 . . . . 1.65 109.522 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.7 mt -63.95 -54.84 28.24 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.036 -0.727 . . . . 1.34 109.036 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.85 -34.65 74.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.565 0.698 . . . . 2.84 109.404 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.88 -38.78 83.19 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.845 -0.535 . . . . 1.33 110.299 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -40.82 84.59 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.24 -0.913 . . . . 1.9 109.884 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -60.39 -45.93 91.8 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.584 -0.698 . . . . 2.85 111.389 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.38 -19.12 61.52 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.327 -0.858 . . . . 2.56 112.034 -178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -59.35 -39.98 84.96 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.365 -0.834 . . . . 2.41 110.745 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.23 -57.42 10.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.575 -0.703 . . . . 2.82 111.092 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.2 m -151.51 19.29 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.236 -0.915 . . . . 2.76 110.776 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.4 39.31 80.68 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.656 -1.378 . . . . 1.91 109.656 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 50' ' ' GLU . 96.6 mm-40 -90.2 -15.39 31.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.606 -0.937 . . . . 3.05 112.2 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' O ' ' A' ' 49' ' ' GLN . 14.8 pt-20 39.75 -176.33 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.608 0 N-CA-C 113.274 0.842 . . . . 2.37 113.274 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -75.27 70.74 2.22 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.944 -1.098 . . . . 3.0 110.724 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.6 mttp -68.4 150.61 97.64 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 5.37 109.278 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -69.78 -58.3 0.1 Allowed 'Trans proline' 0 C--N 1.318 -1.034 0 O-C-N 123.23 1.121 . . . . 3.88 110.305 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -82.83 48.85 4.09 Favored Glycine 0 N--CA 1.49 2.247 0 C-N-CA 119.517 -1.325 . . . . 3.24 110.227 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -143.75 59.45 7.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.291 -1.123 . . . . 4.41 110.222 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -69.98 150.01 66.26 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.743 1.391 . . . . 4.33 110.542 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 C--N 1.318 -1.075 0 O-C-N 123.306 1.161 . . . . 4.82 110.413 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.065 0.46 . . . . 3.98 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m -64.12 -40.92 97.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.585 -0.697 . . . . 2.33 110.71 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.6 tp -62.42 -42.4 99.42 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.509 -0.744 . . . . 2.22 109.807 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.75 -46.66 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 C-N-CA 120.441 -0.503 . . . . 2.11 109.872 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -42.51 93.31 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.313 -0.867 . . . . 2.46 109.343 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -59.89 -39.93 87.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.67 -0.644 . . . . 4.15 110.15 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -60.03 -39.98 87.76 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.29 -0.882 . . . . 2.09 110.286 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -59.99 -47.3 86.37 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.689 -0.632 . . . . 3.44 110.892 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.437 HG23 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -69.12 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.122 -0.986 . . . . 1.77 109.434 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.437 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.527 -0.733 . . . . 0.99 110.486 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.96 -49.04 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.737 -0.602 . . . . 1.59 110.756 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.41 ' CG ' HD22 ' A' ' 36' ' ' LEU . 0.9 OUTLIER -60.02 -50.09 75.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.479 -0.763 . . . . 2.4 109.577 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.93 -55.01 4.23 Favored Glycine 0 N--CA 1.507 3.368 0 N-CA-C 110.49 -1.044 . . . . 0.41 110.49 -178.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -63.34 -35.26 79.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.844 -0.797 . . . . 1.12 111.923 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 72.5 t -59.99 -43.58 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.23 -0.919 . . . . 1.2 109.828 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.403 HG21 ' CB ' ' A' ' 32' ' ' ALA . 62.5 t -59.99 -44.53 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.457 -0.777 . . . . 1.34 109.597 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.675 -0.641 . . . . 3.65 110.806 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.01 -44.03 94.82 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.441 -0.787 . . . . 2.23 111.414 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.6 mp -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.328 -0.858 . . . . 1.66 110.337 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -62.58 -39.97 95.38 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.196 -0.668 . . . . 2.58 109.196 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.3 -25.48 67.14 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.583 -0.895 . . . . 1.25 108.583 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.29 6.86 24.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.747 -0.596 . . . . 2.6 110.399 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 55.41 25.82 8.11 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.231 -0.918 . . . . 2.74 110.812 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.47 170.33 0.81 Allowed Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.761 -0.587 . . . . 1.22 110.061 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.26 154.85 61.42 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.33 1.174 . . . . 1.03 110.012 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -54.47 -24.79 21.78 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.36 -0.837 . . . . 2.52 111.159 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.521 -0.737 . . . . 2.22 110.438 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -72.6 -46.44 54.23 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.457 -0.777 . . . . 1.46 110.974 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.8 t -66.04 -49.72 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.648 -0.657 . . . . 1.37 110.608 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -59.93 -50.92 71.87 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.388 -0.82 . . . . 1.33 111.625 -179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.46 90.02 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.038 -1.039 . . . . 1.18 110.399 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.403 ' CB ' HG21 ' A' ' 16' ' ' VAL . . . -65.3 -39.98 93.19 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 120.319 -0.552 . . . . 1.16 110.766 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.45 -38.89 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.217 -0.927 . . . . 1.28 109.26 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -60.0 -35.29 74.72 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.754 0.788 . . . . 3.33 109.113 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -59.95 -40.05 87.66 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.408 0.623 . . . . 2.22 109.587 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.41 HD22 ' CG ' ' A' ' 12' ' ' GLN . 35.3 mt -59.25 -40.03 84.69 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 120.115 -0.634 . . . . 2.11 109.706 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.7 mp -58.99 -34.67 72.1 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.477 -0.764 . . . . 1.95 109.619 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.6 t -59.96 -39.98 87.46 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.903 -0.777 . . . . 1.65 108.903 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.95 -49.98 75.53 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.629 -0.878 . . . . 1.34 108.629 178.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -62.2 -33.03 73.77 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.916 -0.772 . . . . 2.84 108.916 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.03 -43.01 95.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 1.33 109.748 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -61.26 -44.22 97.6 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.231 -1.026 . . . . 1.9 108.231 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.61 -41.2 94.34 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.545 0.688 . . . . 2.85 109.859 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -60.0 -36.35 77.0 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.714 -0.616 . . . . 2.56 111.486 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -56.27 -40.02 73.58 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.322 -0.861 . . . . 2.41 110.745 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.09 -62.83 1.23 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.701 -0.8 . . . . 2.82 110.795 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.2 t -165.78 29.39 0.05 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.303 -0.873 . . . . 2.76 111.613 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.05 63.87 3.42 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 109.136 -1.586 . . . . 1.91 109.136 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 99.6 mt-30 -83.11 -32.15 26.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.656 -0.909 . . . . 3.05 110.462 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 32.31 98.48 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 113.38 0.881 . . . . 2.37 113.38 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -56.49 139.98 47.54 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.148 -0.97 . . . . 3.0 110.513 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttp -68.65 159.41 81.93 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 5.37 110.694 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.66 -4.82 16.0 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 O-C-N 123.467 1.246 . . . . 3.88 111.435 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -82.49 9.59 58.11 Favored Glycine 0 N--CA 1.496 2.665 0 C-N-CA 119.864 -1.16 . . . . 3.24 111.478 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m120 56.6 174.5 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.07 0 O-C-N 120.896 -1.355 . . . . 4.41 110.77 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.401 ' HD3' ' CB ' ' A' ' 10' ' ' ALA . 38.1 Cg_endo -69.99 150.02 66.22 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.55 1.289 . . . . 4.33 110.68 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo . . . . . 0 C--N 1.318 -1.077 0 O-C-N 123.565 1.297 . . . . 4.82 110.605 -179.355 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 50.7 p-10 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 120.979 0.418 . . . . 3.98 110.321 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.3 m -71.38 59.44 0.28 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.522 -0.736 . . . . 2.33 110.507 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.81 -44.35 97.03 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.659 0.742 . . . . 2.22 109.82 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.03 -41.93 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.928 -0.483 . . . . 2.11 111.146 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -59.98 -47.97 83.65 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.317 -0.864 . . . . 2.46 110.149 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.418 ' CZ ' ' O ' ' A' ' 56' ' ' PRO . 8.1 m-85 -57.42 -38.31 74.16 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.522 -0.736 . . . . 4.15 110.418 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.01 -40.08 88.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.522 -0.736 . . . . 2.09 110.563 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -60.02 -48.89 79.83 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.457 -0.777 . . . . 3.44 110.835 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.6 m -65.77 -39.92 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 C-N-CA 119.327 -0.949 . . . . 1.77 109.715 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -40.54 98.06 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.493 -0.754 . . . . 0.99 110.55 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 65.8 t -60.66 -42.72 92.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.655 -0.653 . . . . 1.59 110.777 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -62.89 -56.44 17.29 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.132 -0.98 . . . . 2.4 109.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -37.71 -52.74 1.93 Allowed Glycine 0 N--CA 1.512 3.763 0 N-CA-C 110.717 -0.953 . . . . 0.41 110.717 -178.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -61.71 -38.73 88.94 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.976 -0.72 . . . . 1.12 110.941 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.96 -40.18 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.324 -0.86 . . . . 1.2 110.023 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 71.8 t -60.04 -49.96 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 121.024 -1.047 . . . . 1.34 108.805 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 68.1 ttt-85 -60.07 -44.44 94.75 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 121.459 0.647 . . . . 3.65 110.167 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.14 -48.31 82.26 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.81 -0.556 . . . . 2.23 110.737 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.97 -46.07 90.62 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 120.043 -0.663 . . . . 1.66 110.105 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -66.31 -39.99 89.65 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.414 -0.958 . . . . 2.58 108.414 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.73 -30.55 70.84 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 108.675 -0.861 . . . . 1.25 108.675 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 61.1 mtpt -85.6 10.72 12.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.44 -0.504 . . . . 2.6 110.873 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.2 mtmt 59.91 20.14 9.13 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.302 -0.874 . . . . 2.74 111.195 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.4 165.19 4.18 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.554 -0.716 . . . . 1.22 109.953 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.61 160.55 49.08 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.32 1.168 . . . . 1.03 111.349 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.405 ' O ' HG11 ' A' ' 29' ' ' VAL . 33.9 mtpt -55.83 -25.71 43.12 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.574 -0.704 . . . . 2.52 110.446 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -59.98 -39.91 87.3 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.152 -0.968 . . . . 2.22 109.953 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -70.0 -49.63 49.57 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.437 -0.789 . . . . 1.46 111.42 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.407 ' CG1' ' N ' ' A' ' 30' ' ' ASP . 8.4 p -65.05 -43.25 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.406 -0.809 . . . . 1.37 110.221 -179.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.407 ' N ' ' CG1' ' A' ' 29' ' ' VAL . 95.6 m-20 -60.03 -41.75 92.89 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.8 -0.562 . . . . 1.33 110.792 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.64 -50.11 72.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.447 -0.783 . . . . 1.18 110.797 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.46 -41.52 93.3 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 120.182 -0.607 . . . . 1.16 110.331 -179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.413 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -67.12 -38.87 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 107.412 -1.329 . . . . 1.28 107.412 178.498 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -60.43 -46.36 90.33 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.342 -0.984 . . . . 3.33 108.342 177.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -64.23 -40.92 97.04 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.095 -1.076 . . . . 2.22 108.095 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 17.2 tp -60.0 -40.33 88.84 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 115.626 -0.715 . . . . 2.11 110.322 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.5 mt -59.96 -40.0 87.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.219 -0.926 . . . . 1.95 109.722 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.3 m -60.44 -37.02 79.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.424 -0.798 . . . . 1.65 109.347 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -59.98 -56.24 24.1 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.672 -0.643 . . . . 1.34 110.439 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 17.6 ptmt -62.11 -35.88 80.06 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.317 -0.865 . . . . 2.84 109.23 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.421 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -60.76 -43.77 97.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.112 -0.495 . . . . 1.33 110.488 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.04 -47.6 85.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.111 -0.993 . . . . 1.9 109.259 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.437 ' CE2' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -61.22 -38.7 87.54 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.498 -0.751 . . . . 2.85 109.042 178.081 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.8 ttpt -60.34 -27.27 67.23 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.749 -0.594 . . . . 2.56 111.081 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -55.6 -37.76 68.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.26 -0.9 . . . . 2.41 110.961 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -62.82 -77.71 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.443 -0.786 . . . . 2.82 110.014 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 t -161.49 40.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.31 -0.869 . . . . 2.76 110.241 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.71 65.75 2.4 Favored Glycine 0 N--CA 1.496 2.698 0 N-CA-C 109.972 -1.251 . . . . 1.91 109.972 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.437 ' HB3' ' CE2' ' A' ' 43' ' ' TYR . 81.6 mm-40 -86.43 -21.75 26.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.467 -1.019 . . . . 3.05 111.608 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 9.0 pt-20 32.21 92.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 112.811 0.671 . . . . 2.37 112.811 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -57.7 138.43 55.45 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.126 -0.984 . . . . 3.0 110.716 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.1 mmtt -65.12 166.32 13.41 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.645 . . . . 5.37 109.414 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -62.24 -33.72 80.26 Favored 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.125 1.066 . . . . 3.88 111.228 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.86 -3.08 89.15 Favored Glycine 0 N--CA 1.493 2.495 0 C-N-CA 119.313 -1.423 . . . . 3.24 110.665 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.415 ' N ' ' CD ' ' A' ' 56' ' ' PRO . 69.3 m-80 49.52 49.94 8.3 Favored Pre-proline 0 N--CA 1.506 2.348 0 O-C-N 121.047 -1.266 . . . . 4.41 111.656 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.418 ' O ' ' CZ ' ' A' ' 6' ' ' TYR . 37.2 Cg_endo -70.05 149.97 65.8 Favored 'Trans proline' 0 N--CA 1.487 1.112 0 O-C-N 123.166 1.087 . . . . 4.33 110.991 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 N--CA 1.488 1.174 0 O-C-N 123.417 1.22 . . . . 4.82 110.616 179.256 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.418 ' O ' HG12 ' A' ' 4' ' ' VAL . 78.2 m-20 . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.374 0.607 . . . . 3.98 110.004 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m -66.99 -39.96 87.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.39 -0.819 . . . . 2.33 110.682 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.9 tt -61.2 -50.95 71.05 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.485 -0.76 . . . . 2.22 112.474 -177.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.418 HG12 ' O ' ' A' ' 1' ' ' ASP . 14.7 p -58.64 -39.5 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.089 -1.007 . . . . 2.11 110.251 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.439 HD12 ' CZ ' ' A' ' 43' ' ' TYR . 0.5 OUTLIER -58.93 -39.96 83.18 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 109.394 -0.595 . . . . 2.46 109.394 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.409 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 m-85 -59.11 -38.26 79.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.614 -0.679 . . . . 4.15 110.103 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -60.04 -40.75 90.48 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.14 -0.975 . . . . 2.09 109.938 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -60.01 -49.52 77.32 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.762 -0.586 . . . . 3.44 110.715 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.473 HG21 ' N ' ' A' ' 10' ' ' ALA . 26.5 m -66.76 -39.46 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.391 -0.818 . . . . 1.77 109.565 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.473 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -60.51 -37.1 80.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.534 -0.728 . . . . 0.99 110.319 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 64.2 t -60.01 -49.95 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.625 -0.672 . . . . 1.59 109.76 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.37 -56.13 21.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.353 -0.842 . . . . 2.4 109.876 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -36.42 -52.5 1.35 Allowed Glycine 0 N--CA 1.514 3.866 0 N-CA-C 110.907 -0.877 . . . . 0.41 110.907 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -62.26 -37.93 87.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.884 -0.774 . . . . 1.12 111.289 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 76.2 t -59.52 -40.56 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.329 -0.857 . . . . 1.2 109.469 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.1 t -59.98 -49.6 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.4 -0.812 . . . . 1.34 109.004 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -60.0 -43.48 95.19 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.581 -0.699 . . . . 3.65 110.423 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -60.4 -39.5 87.57 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.481 -0.762 . . . . 2.23 111.255 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.02 -40.5 89.54 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.374 -0.829 . . . . 1.66 110.924 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -66.24 -40.26 90.1 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.35 -0.844 . . . . 2.58 109.326 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.39 66.93 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.171 -1.048 . . . . 1.25 108.171 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 48.7 mtpt -86.33 9.44 17.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.715 -0.616 . . . . 2.6 111.007 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 57.9 mtpt 58.08 24.77 11.6 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.28 -0.888 . . . . 2.74 110.822 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 157.99 40.65 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.777 -0.577 . . . . 1.22 110.3 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.52 167.44 27.03 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.433 1.228 . . . . 1.03 110.478 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -56.63 -31.86 64.76 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.732 -0.605 . . . . 2.52 109.778 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -59.71 -40.05 86.66 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.637 -0.664 . . . . 2.22 110.533 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -69.81 -42.45 73.69 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.291 -0.881 . . . . 1.46 110.049 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.8 t -67.68 -48.95 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 CA-C-O 121.39 0.614 . . . . 1.37 109.773 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -59.92 -46.87 87.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.658 -0.652 . . . . 1.33 111.198 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.29 -47.72 84.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.333 -0.855 . . . . 1.18 110.758 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.75 -44.99 88.32 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.497 -0.752 . . . . 1.16 110.247 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -38.51 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.031 -1.1 . . . . 1.28 108.031 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.06 -45.5 92.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 108.07 -1.085 . . . . 3.33 108.07 177.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -63.57 -43.15 97.84 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 122.117 0.961 . . . . 2.22 108.604 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.4 tp -59.96 -42.44 94.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.833 -0.621 . . . . 2.11 110.096 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.03 -38.72 83.55 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.499 -0.75 . . . . 1.95 110.384 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 p -59.98 -37.57 80.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.365 -0.835 . . . . 1.65 109.337 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.7 mt -62.23 -52.93 61.8 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.609 -0.886 . . . . 1.34 108.609 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.58 -38.37 84.37 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.42 0.629 . . . . 2.84 109.361 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.39 93.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.757 -0.59 . . . . 1.33 109.762 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -60.08 -44.9 94.43 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.617 -0.882 . . . . 1.9 108.617 178.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.439 ' CZ ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -60.19 -43.34 95.98 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.433 0.635 . . . . 2.85 110.101 178.358 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.54 -29.03 68.88 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.722 -0.611 . . . . 2.56 111.793 -179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -55.97 -39.97 72.58 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.288 -0.882 . . . . 2.41 111.212 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.31 -64.39 0.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.397 -0.815 . . . . 2.82 110.79 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -165.94 32.79 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.383 -0.823 . . . . 2.76 110.994 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.59 70.58 1.2 Allowed Glycine 0 N--CA 1.498 2.788 0 N-CA-C 110.398 -1.081 . . . . 1.91 110.398 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 50' ' ' GLU . 60.6 mm-40 -85.92 -28.01 24.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.537 -0.978 . . . . 3.05 110.405 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.492 ' O ' ' O ' ' A' ' 49' ' ' GLN . 16.2 pt-20 39.47 114.98 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 122.892 1.33 . . . . 2.37 113.088 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 10' ' ' ALA . 13.9 t80 -55.9 131.47 47.15 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.844 -1.16 . . . . 3.0 110.668 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -69.55 154.51 94.76 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.771 -0.58 . . . . 5.37 109.488 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -80.34 -20.2 8.54 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.344 1.181 . . . . 3.88 111.55 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.05 32.57 3.76 Favored Glycine 0 N--CA 1.497 2.722 0 C-N-CA 119.87 -1.157 . . . . 3.24 112.4 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.411 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 1.3 m-20 55.52 179.91 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 120.73 -1.453 . . . . 4.41 110.089 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.411 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 38.1 Cg_endo -70.0 149.99 66.15 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.148 1.078 . . . . 4.33 109.666 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 C--N 1.317 -1.106 0 O-C-N 123.255 1.134 . . . . 4.82 110.511 -179.763 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.115 0.483 . . . . 3.98 110.266 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.5 t -65.53 -46.33 80.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.539 -0.726 . . . . 2.33 110.662 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 37.5 tp -64.77 -52.65 55.83 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.503 -0.748 . . . . 2.22 110.845 -179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.9 p -59.56 -46.36 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.59 -0.694 . . . . 2.11 110.904 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 85.0 mt -61.38 -40.03 92.83 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.346 -0.846 . . . . 2.46 109.404 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 51' ' ' TYR . 32.3 t80 -59.93 -39.85 86.93 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.045 -0.724 . . . . 4.15 109.045 178.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -60.14 -39.88 87.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.408 -0.807 . . . . 2.09 109.995 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -58.94 -49.97 75.82 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.382 -0.824 . . . . 3.44 110.431 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.424 HG21 ' N ' ' A' ' 10' ' ' ALA . 28.0 m -68.43 -38.19 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.156 -0.965 . . . . 1.77 108.626 178.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.424 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -59.98 -38.15 81.71 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.745 -0.597 . . . . 0.99 110.346 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.03 -50.38 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.678 -0.639 . . . . 1.59 110.78 -178.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -61.72 -49.24 77.26 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.202 -0.999 . . . . 2.4 109.923 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -45.04 -48.65 9.65 Favored Glycine 0 N--CA 1.506 3.333 0 N-CA-C 109.561 -1.415 . . . . 0.41 109.561 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -64.04 -35.99 82.52 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.889 -0.771 . . . . 1.12 110.742 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.01 -40.05 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.414 -0.804 . . . . 1.2 109.809 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.1 t -59.98 -49.72 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 108.247 -1.019 . . . . 1.34 108.247 178.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -60.04 -45.34 93.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.696 -0.627 . . . . 3.65 110.211 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.94 -40.04 91.75 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.62 -0.675 . . . . 2.23 111.063 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 71.9 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.433 -0.792 . . . . 1.66 110.685 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.6 mmtp -63.37 -40.06 96.23 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.164 -0.68 . . . . 2.58 109.164 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.55 -26.39 68.68 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.522 -0.918 . . . . 1.25 108.522 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 76.5 mttt -86.03 8.73 19.49 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.791 -0.568 . . . . 2.6 110.629 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 48.3 mttp 59.31 20.03 8.22 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.308 -0.87 . . . . 2.74 110.545 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.58 155.9 56.97 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.59 -0.694 . . . . 1.22 110.013 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.45 160.36 50.08 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.434 1.229 . . . . 1.03 110.454 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -55.05 -26.49 37.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.498 -0.751 . . . . 2.52 110.53 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -59.95 -40.01 87.52 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.577 -0.702 . . . . 2.22 110.898 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -69.86 -43.12 72.52 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.404 -0.81 . . . . 1.46 111.023 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 90.4 t -68.02 -43.79 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 1.37 110.287 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -59.99 -43.52 95.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -0.754 . . . . 1.33 111.322 -179.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.66 83.96 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.378 -0.826 . . . . 1.18 110.928 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.48 -40.14 95.11 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 120.006 -0.677 . . . . 1.16 110.686 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.17 -39.96 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 119.487 -0.885 . . . . 1.28 108.881 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -60.44 -40.95 92.97 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.198 -1.038 . . . . 3.33 108.198 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.3 -39.57 93.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.303 -0.999 . . . . 2.22 108.303 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -57.88 -40.01 79.21 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 116.033 -0.53 . . . . 2.11 109.851 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mp -56.77 -39.11 73.46 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.172 -0.955 . . . . 1.95 109.005 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.4 t -59.96 -39.65 86.34 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.87 -0.789 . . . . 1.65 108.87 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.7 mt -64.31 -39.8 94.63 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.935 -0.765 . . . . 1.34 108.935 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -59.25 -37.37 77.44 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.805 -0.559 . . . . 2.84 109.593 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.95 -39.99 87.46 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.585 -0.697 . . . . 1.33 109.799 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.53 -41.77 92.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.298 -0.876 . . . . 1.9 109.614 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.414 ' CE2' ' HA ' ' A' ' 51' ' ' TYR . 53.1 t80 -60.01 -47.24 86.63 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.653 -0.655 . . . . 2.85 111.782 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.457 ' HG3' ' N ' ' A' ' 45' ' ' GLU . 0.5 OUTLIER -55.67 -28.75 57.2 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.562 -0.711 . . . . 2.56 111.614 -177.037 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.457 ' N ' ' HG3' ' A' ' 44' ' ' LYS . 58.1 mm-40 -60.02 -39.93 87.58 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.256 -0.903 . . . . 2.41 110.5 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -63.31 -52.78 60.5 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.513 -0.742 . . . . 2.82 112.238 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 m -156.37 -70.92 0.11 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.011 -1.056 . . . . 2.76 112.767 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -86.63 -113.83 0.91 Allowed Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.926 -1.13 . . . . 1.91 113.2 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.426 ' HA ' ' CB ' ' A' ' 44' ' ' LYS . 32.9 mt-30 -140.98 -30.26 0.64 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.994 -0.71 . . . . 3.05 112.87 -176.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -158.02 155.74 29.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.086 -1.009 . . . . 2.37 111.425 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.435 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 51.7 p90 -65.88 150.26 48.88 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.693 -0.629 . . . . 3.0 110.454 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -62.56 148.42 90.67 Favored Pre-proline 0 N--CA 1.498 1.972 0 O-C-N 121.487 -0.758 . . . . 5.37 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -76.56 8.95 2.77 Favored 'Trans proline' 0 N--CA 1.487 1.091 0 O-C-N 123.326 1.172 . . . . 3.88 112.915 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.85 20.06 17.51 Favored Glycine 0 N--CA 1.499 2.9 0 O-C-N 120.781 -1.199 . . . . 3.24 112.052 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 57.58 174.77 0.04 OUTLIER Pre-proline 0 N--CA 1.505 2.276 0 O-C-N 120.83 -1.394 . . . . 4.41 110.76 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -69.99 149.99 66.2 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 O-C-N 123.497 1.262 . . . . 4.33 111.033 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo . . . . . 0 N--CA 1.485 1.029 0 O-C-N 123.513 1.27 . . . . 4.82 110.482 179.975 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 121.252 0.548 . . . . 3.98 110.499 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m -60.0 -39.96 87.55 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 2.33 110.525 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.46 -41.01 93.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.667 -0.646 . . . . 2.22 110.511 -179.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 84.5 t -59.93 -49.79 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.201 -0.937 . . . . 2.11 109.094 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.04 -38.12 81.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.639 -0.663 . . . . 2.46 109.927 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 52' ' ' LYS . 17.0 t80 -59.98 -40.0 87.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.599 -0.688 . . . . 4.15 110.127 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -60.02 -39.64 86.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.499 -0.751 . . . . 2.09 110.23 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -59.97 -51.11 71.07 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.38 -0.825 . . . . 3.44 110.534 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.405 ' HA ' ' CD1' ' A' ' 39' ' ' LEU . 8.3 p -69.04 -42.5 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.452 -0.78 . . . . 1.77 109.785 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.05 -47.61 85.15 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.543 -0.723 . . . . 0.99 111.269 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.1 t -60.02 -48.13 89.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.61 -0.681 . . . . 1.59 110.732 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.24 -55.17 31.02 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.194 -0.941 . . . . 2.4 109.709 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.94 -55.02 2.92 Favored Glycine 0 N--CA 1.508 3.445 0 N-CA-C 111.095 -0.802 . . . . 0.41 111.095 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -63.87 -38.46 91.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.75 -0.853 . . . . 1.12 111.377 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 72.6 t -59.46 -40.05 80.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.459 -0.776 . . . . 1.2 109.683 -178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.96 -50.05 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.271 -0.893 . . . . 1.34 108.67 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.6 ttp85 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.604 -0.685 . . . . 3.65 109.967 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -60.11 -45.14 93.96 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.626 -0.671 . . . . 2.23 110.442 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.95 -40.09 87.8 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.401 0.62 . . . . 1.66 110.088 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.4 tptm -63.33 -40.15 96.53 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.018 -0.734 . . . . 2.58 109.018 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.44 -27.81 68.78 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.214 -1.032 . . . . 1.25 108.214 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 59.5 mtpt -86.37 9.11 18.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.765 -0.585 . . . . 2.6 110.904 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 56.1 mttm 59.32 22.11 10.44 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.28 -0.887 . . . . 2.74 110.9 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.27 161.09 10.6 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.603 -0.686 . . . . 1.22 110.397 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.12 158.3 52.42 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.462 1.243 . . . . 1.03 110.143 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -55.48 -28.06 52.21 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.501 -0.75 . . . . 2.52 110.448 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -59.33 -41.63 89.56 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.624 -0.672 . . . . 2.22 110.352 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -70.5 -42.78 70.89 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.489 -0.757 . . . . 1.46 110.37 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 65.7 t -68.86 -49.39 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.726 -0.609 . . . . 1.37 110.522 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.08 -43.23 95.64 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.433 -0.792 . . . . 1.33 111.491 -179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -49.99 75.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.308 -0.87 . . . . 1.18 110.707 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.32 -41.57 93.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.188 -0.605 . . . . 1.16 110.548 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -38.44 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 108.262 -1.014 . . . . 1.28 108.262 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -60.82 -41.21 95.28 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.687 -0.857 . . . . 3.33 108.687 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.1 tp60 -64.69 -41.93 95.68 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.221 -1.029 . . . . 2.22 108.221 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.01 -41.18 91.59 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 116.065 -0.516 . . . . 2.11 110.093 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.9 mt -59.6 -40.01 86.06 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.409 -0.807 . . . . 1.95 109.946 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.6 m -60.08 -39.99 88.01 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.593 -0.692 . . . . 1.65 109.255 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.405 ' CD1' ' HA ' ' A' ' 9' ' ' VAL . 64.7 mt -65.1 -46.5 80.82 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.453 -0.943 . . . . 1.34 108.453 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -60.04 -40.98 91.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.926 -0.484 . . . . 2.84 110.348 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.05 -40.44 97.7 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.527 -0.733 . . . . 1.33 110.285 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -66.76 -39.98 88.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.52 -0.737 . . . . 1.9 110.037 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -43.62 95.14 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.542 -0.724 . . . . 2.85 109.952 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -63.71 -27.6 69.32 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.668 -0.645 . . . . 2.56 111.81 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -39.57 69.3 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.151 -0.968 . . . . 2.41 110.911 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -62.24 -58.41 7.85 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.568 -0.708 . . . . 2.82 110.276 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.4 t -161.43 29.57 0.13 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.461 -0.774 . . . . 2.76 110.377 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.46 47.64 27.37 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.526 -1.03 . . . . 1.91 110.526 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -85.71 -11.43 53.71 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.356 -1.085 . . . . 3.05 111.163 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 35.97 -157.76 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.689 0 N-CA-C 112.519 0.562 . . . . 2.37 112.519 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.4 ' CD2' HG21 ' A' ' 9' ' ' VAL . 33.4 t80 -67.59 116.15 7.99 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.275 -0.891 . . . . 3.0 109.919 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 10.2 mmmt -69.95 135.77 87.46 Favored Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.482 -0.761 . . . . 5.37 109.58 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -81.34 -166.99 0.44 Allowed 'Trans proline' 0 C--N 1.318 -1.061 0 O-C-N 123.095 1.05 . . . . 3.88 111.212 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 75.63 5.54 78.83 Favored Glycine 0 N--CA 1.495 2.604 0 O-C-N 121.681 -0.637 . . . . 3.24 112.029 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.419 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 72.7 m-80 55.46 165.55 0.06 OUTLIER Pre-proline 0 N--CA 1.506 2.363 0 CA-C-N 118.693 1.247 . . . . 4.41 111.164 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 55' ' ' ASN . 37.9 Cg_endo -70.02 150.01 66.02 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 O-C-N 122.946 0.972 . . . . 4.33 111.182 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.32 -0.961 0 O-C-N 123.522 1.275 . . . . 4.82 110.501 179.908 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 121.209 0.528 . . . . 3.98 110.69 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -69.22 -10.39 57.54 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.597 -0.69 . . . . 2.33 111.108 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.95 -42.9 95.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.231 -0.918 . . . . 2.22 111.197 -178.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 29.6 m -54.93 -43.42 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.212 -0.93 . . . . 2.11 110.622 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.9 -40.1 91.81 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.453 -0.779 . . . . 2.46 109.69 178.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.404 ' O ' HG23 ' A' ' 9' ' ' VAL . 5.4 t80 -59.66 -39.37 84.2 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.542 0.687 . . . . 4.15 110.028 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -59.97 -39.34 85.32 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.756 . . . . 2.09 110.048 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.4 mmm-85 -60.01 -49.91 75.8 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.768 . . . . 3.44 110.519 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.447 HG22 ' N ' ' A' ' 10' ' ' ALA . 32.9 m -67.19 -40.07 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 C-N-CA 119.235 -0.986 . . . . 1.77 108.417 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -61.65 -39.96 93.2 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.756 -0.59 . . . . 0.99 111.437 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.6 t -59.99 -52.16 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.481 -0.762 . . . . 1.59 111.411 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 96.5 mm-40 -60.17 -47.28 86.6 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.242 -0.911 . . . . 2.4 110.477 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.54 -52.59 4.47 Favored Glycine 0 N--CA 1.509 3.531 0 N-CA-C 109.936 -1.266 . . . . 0.41 109.936 -178.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -65.97 -37.04 84.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 122.122 -0.634 . . . . 1.12 111.256 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 93.3 t -60.02 -40.31 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.315 -0.866 . . . . 1.2 109.689 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.04 -49.91 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 108.878 -0.786 . . . . 1.34 108.878 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.57 -43.0 97.77 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.612 -0.68 . . . . 3.65 110.784 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -61.63 -44.24 97.36 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.408 -0.807 . . . . 2.23 111.084 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 85.9 mt -60.04 -39.97 87.76 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.427 0.632 . . . . 1.66 110.464 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -65.98 -39.99 90.83 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.253 0.549 . . . . 2.58 109.571 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.55 66.85 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 108.918 -0.771 . . . . 1.25 108.918 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 9.1 mtmt -86.69 10.14 16.64 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.614 -0.835 . . . . 2.6 111.001 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 72.9 mmtt 58.85 21.99 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.228 -0.92 . . . . 2.74 110.812 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.68 160.33 10.63 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.516 -0.74 . . . . 1.22 109.944 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.38 167.77 26.37 Favored 'Trans proline' 0 C--N 1.316 -1.168 0 O-C-N 123.359 1.189 . . . . 1.03 109.838 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -53.92 -22.65 10.6 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.544 -0.722 . . . . 2.52 110.364 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -55.74 -45.71 77.94 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.54 -0.725 . . . . 2.22 110.27 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -72.22 -40.9 67.46 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.546 -0.721 . . . . 1.46 111.113 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 55.9 t -68.29 -47.61 77.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.488 -0.758 . . . . 1.37 110.214 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -59.94 -46.43 89.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.715 . . . . 1.33 110.951 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.47 -49.96 73.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.406 -0.809 . . . . 1.18 110.649 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.58 -42.47 95.6 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.042 -0.663 . . . . 1.16 110.358 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -37.84 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.465 -0.939 . . . . 1.28 108.465 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -59.97 -37.87 80.86 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.902 0.858 . . . . 3.33 108.881 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -60.0 -41.56 92.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.936 -0.477 . . . . 2.22 109.761 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.441 ' HG ' ' HB3' ' A' ' 12' ' ' GLN . 22.6 mt -59.15 -39.97 84.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.837 -0.539 . . . . 2.11 110.771 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.32 -40.58 82.45 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.519 -0.738 . . . . 1.95 110.032 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.5 m -62.35 -39.99 94.94 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.744 -0.783 . . . . 1.65 109.644 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.6 mt -66.9 -51.49 54.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.644 . . . . 1.34 109.379 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -60.72 -39.96 90.54 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.753 -0.592 . . . . 2.84 109.735 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.1 -42.51 94.82 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.885 -0.509 . . . . 1.33 111.042 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -70.03 -43.15 71.88 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.324 -0.86 . . . . 1.9 110.749 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.429 ' CD1' ' CB ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -62.02 -49.02 77.69 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 2.85 112.352 -179.335 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -59.7 -23.16 62.9 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.225 -0.922 . . . . 2.56 111.429 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -60.04 -39.99 87.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.418 -0.801 . . . . 2.41 110.807 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.99 -60.06 2.79 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.374 -0.93 . . . . 2.82 110.561 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.7 m -160.18 45.29 0.22 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.148 -0.97 . . . . 2.76 111.868 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.38 42.08 96.17 Favored Glycine 0 N--CA 1.5 2.911 0 N-CA-C 109.073 -1.611 . . . . 1.91 109.073 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.429 ' CB ' ' CD1' ' A' ' 43' ' ' TYR . 93.8 mt-30 -96.76 28.35 3.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.703 -0.88 . . . . 3.05 110.939 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -52.41 178.44 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.712 -0.617 . . . . 2.37 110.849 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -55.13 102.94 0.08 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.541 -0.724 . . . . 3.0 111.519 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -70.38 156.04 92.5 Favored Pre-proline 0 N--CA 1.494 1.726 0 N-CA-C 109.158 -0.682 . . . . 5.37 109.158 178.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -76.82 -175.39 2.6 Favored 'Trans proline' 0 C--N 1.314 -1.246 0 O-C-N 123.24 1.126 . . . . 3.88 111.446 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 73.95 4.43 67.16 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 111.39 -0.684 . . . . 3.24 111.39 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.0 174.31 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.19 0 O-C-N 120.963 -1.316 . . . . 4.41 110.808 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.0 150.02 66.18 Favored 'Trans proline' 0 N--CA 1.487 1.106 0 O-C-N 123.387 1.204 . . . . 4.33 110.326 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 C--N 1.316 -1.141 0 O-C-N 123.431 1.227 . . . . 4.82 110.472 -179.747 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 121.34 0.59 . . . . 3.98 110.236 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -61.31 -40.0 92.58 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.614 -0.679 . . . . 2.33 110.543 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.13 -41.02 97.85 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.477 -0.764 . . . . 2.22 109.872 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.4 t -59.82 -41.06 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.88 -0.513 . . . . 2.11 110.421 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 mt -60.01 -43.5 95.19 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.251 -0.906 . . . . 2.46 109.843 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.02 -39.11 84.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.611 -0.68 . . . . 4.15 109.75 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -60.99 -40.64 94.27 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 2.09 110.719 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.7 -50.39 73.67 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.298 -0.876 . . . . 3.44 110.956 -179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.419 HG22 ' CD2' ' A' ' 51' ' ' TYR . 17.5 m -70.14 -40.57 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 1.77 108.472 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.84 -50.54 73.01 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 112.89 0.7 . . . . 0.99 112.89 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.8 m -60.2 -45.2 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.169 -0.957 . . . . 1.59 111.827 -177.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -60.15 -50.39 73.88 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.049 -1.032 . . . . 2.4 110.372 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -45.79 -41.69 10.34 Favored Glycine 0 N--CA 1.507 3.372 0 N-CA-C 109.302 -1.519 . . . . 0.41 109.302 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -66.16 -37.44 85.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 122.097 -0.649 . . . . 1.12 110.908 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.1 t -60.01 -40.87 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.53 -0.731 . . . . 1.2 110.012 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.5 t -60.69 -46.36 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.281 -0.887 . . . . 1.34 109.045 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -59.95 -40.06 87.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.571 -0.705 . . . . 3.65 110.654 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -59.99 -42.82 95.06 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.546 -0.721 . . . . 2.23 110.059 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.03 -40.03 87.92 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.752 -0.592 . . . . 1.66 110.577 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -60.63 -44.19 96.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.33 -0.856 . . . . 2.58 109.093 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.26 68.55 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.312 -0.996 . . . . 1.25 108.312 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -85.48 8.21 19.95 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.761 -0.587 . . . . 2.6 110.764 179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt 58.46 21.61 8.67 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.242 -0.911 . . . . 2.74 110.755 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.61 148.68 80.91 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.633 -0.667 . . . . 1.22 110.183 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -70.36 168.2 23.03 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.418 1.22 . . . . 1.03 110.898 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.3 mmmt -55.92 -30.74 62.1 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.811 -0.555 . . . . 2.52 110.84 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -59.09 -40.02 83.98 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.498 -0.751 . . . . 2.22 110.532 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -71.48 -44.07 65.43 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.433 -0.792 . . . . 1.46 110.478 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.08 -40.58 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.69 -0.631 . . . . 1.37 110.328 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -59.27 -47.84 83.86 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.334 -0.853 . . . . 1.33 111.084 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.71 -49.67 75.53 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.114 -0.991 . . . . 1.18 110.651 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.21 -40.14 90.13 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.691 -0.63 . . . . 1.16 110.879 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -38.37 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 108.516 -0.92 . . . . 1.28 108.516 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -60.49 -40.0 89.74 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.527 -0.733 . . . . 3.33 109.197 177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -61.23 -53.07 61.51 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.704 -0.623 . . . . 2.22 109.666 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.16 -40.09 88.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.657 -0.652 . . . . 2.11 109.644 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.06 -39.97 87.84 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.391 -0.818 . . . . 1.95 109.583 179.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -59.99 -39.47 85.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 1.65 109.391 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.6 mt -59.96 -55.21 36.86 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.618 -0.676 . . . . 1.34 110.581 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.7 pttp -65.77 -29.96 70.54 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.175 -0.953 . . . . 2.84 109.428 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.59 92.52 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.295 -0.562 . . . . 1.33 109.645 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -63.83 -44.64 92.63 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.233 -1.025 . . . . 1.9 108.233 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -60.42 -41.65 94.4 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.623 0.725 . . . . 2.85 109.836 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.98 -39.75 86.79 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.829 -0.545 . . . . 2.56 111.237 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -55.68 -40.01 71.73 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.347 -0.846 . . . . 2.41 111.187 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -63.71 -85.01 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.234 -0.916 . . . . 2.82 110.623 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.4 t -159.97 51.75 0.33 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.014 -1.054 . . . . 2.76 111.705 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.28 41.22 69.11 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.616 -0.994 . . . . 1.91 110.616 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -95.56 23.18 6.27 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.47 -1.017 . . . . 3.05 111.048 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.9 141.18 55.94 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.592 0.711 . . . . 2.37 110.236 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.419 ' CD2' HG22 ' A' ' 9' ' ' VAL . 55.6 p90 -56.29 149.11 17.05 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.502 0.668 . . . . 3.0 111.452 -178.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.6 mttm -68.11 158.79 82.97 Favored Pre-proline 0 N--CA 1.496 1.875 0 O-C-N 121.757 -0.59 . . . . 5.37 110.481 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.47 -17.63 48.95 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.327 1.172 . . . . 3.88 112.139 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.37 54.64 Favored Glycine 0 N--CA 1.497 2.754 0 C-N-CA 119.603 -1.284 . . . . 3.24 111.93 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.435 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 3.1 m-20 55.63 178.69 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.405 0 O-C-N 120.749 -1.442 . . . . 4.41 109.879 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 55' ' ' ASN . 37.3 Cg_endo -69.94 149.98 66.49 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 123.036 1.019 . . . . 4.33 110.295 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.318 -1.032 0 O-C-N 123.487 1.256 . . . . 4.82 110.649 -179.386 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 49.8 t0 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.055 0.455 . . . . 3.98 110.326 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -69.9 -12.87 61.94 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.588 -0.695 . . . . 2.33 111.039 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.3 tp -60.63 -39.66 89.06 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.205 -0.934 . . . . 2.22 110.556 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 5' ' ' LEU . 7.8 p -55.27 -43.48 71.15 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.417 -0.802 . . . . 2.11 110.48 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.412 ' N ' ' CG1' ' A' ' 4' ' ' VAL . 81.1 mt -60.2 -40.0 88.56 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.637 -0.664 . . . . 2.46 109.428 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.438 ' CD1' ' HA ' ' A' ' 56' ' ' PRO . 0.3 OUTLIER -57.03 -47.58 80.57 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-O 121.488 0.661 . . . . 4.15 109.599 179.346 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -62.43 -40.07 95.36 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.622 -0.674 . . . . 2.09 110.799 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.422 ' O ' HG21 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -59.97 -49.89 75.88 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.408 -0.808 . . . . 3.44 110.647 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.418 HG21 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -69.03 -40.0 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 1.77 109.23 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.418 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -59.97 -49.74 76.48 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.79 0.663 . . . . 0.99 112.79 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 8' ' ' ARG . 34.2 m -59.88 -45.38 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.172 -0.955 . . . . 1.59 111.037 -177.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -60.93 -49.46 77.37 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.106 -0.996 . . . . 2.4 109.673 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.53 -58.85 2.04 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.408 -1.077 . . . . 0.41 110.408 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -63.64 -36.29 83.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.835 -0.803 . . . . 1.12 111.028 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 90.1 t -60.01 -40.48 83.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.332 -0.855 . . . . 1.2 109.579 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 66.5 t -60.2 -50.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.394 -0.816 . . . . 1.34 109.235 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -62.56 -42.95 99.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.65 -0.657 . . . . 3.65 111.244 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.96 -44.44 94.43 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.557 -0.714 . . . . 2.23 110.722 -178.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.4 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.822 -0.549 . . . . 1.66 110.904 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -65.99 -40.05 90.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.646 -0.659 . . . . 2.58 109.383 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.58 -26.99 67.36 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.841 -0.8 . . . . 1.25 108.841 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 98.3 mttt -86.17 9.13 18.39 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.058 -0.657 . . . . 2.6 110.509 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 84.6 mttt 58.97 19.94 7.68 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.377 -0.827 . . . . 2.74 110.968 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.94 167.58 1.88 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.57 -0.706 . . . . 1.22 109.734 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.61 163.99 36.03 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 O-C-N 123.355 1.187 . . . . 1.03 110.107 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mttp -54.59 -23.55 17.38 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.473 -0.767 . . . . 2.52 109.594 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -56.71 -40.57 75.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.704 -0.623 . . . . 2.22 110.383 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -73.22 -42.27 62.82 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.545 -0.722 . . . . 1.46 111.023 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.5 t -69.94 -54.04 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.538 -0.726 . . . . 1.37 110.963 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -60.21 -41.02 92.13 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.43 -0.794 . . . . 1.33 112.101 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.95 75.41 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.241 -0.912 . . . . 1.18 110.9 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.43 -41.41 89.23 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 119.938 -0.705 . . . . 1.16 110.192 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -39.03 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.044 -1.095 . . . . 1.28 108.044 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -60.26 -43.74 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.179 -1.045 . . . . 3.33 108.179 177.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -65.81 -45.81 80.96 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.562 -0.903 . . . . 2.22 108.562 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 tp -59.69 -39.95 86.28 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 109.749 -0.463 . . . . 2.11 109.749 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -58.9 -39.99 83.13 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.369 -0.832 . . . . 1.95 109.512 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -61.53 -41.53 97.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 1.65 109.137 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.417 ' HB3' ' CG1' ' A' ' 9' ' ' VAL . 71.6 mt -62.57 -49.93 73.33 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.818 -0.808 . . . . 1.34 108.818 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -60.06 -40.02 88.03 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.56 0.695 . . . . 2.84 109.231 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.7 -44.27 96.78 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.951 -0.468 . . . . 1.33 110.649 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.01 -47.17 86.95 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.248 -0.907 . . . . 1.9 109.594 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -42.74 94.79 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.918 0.866 . . . . 2.85 109.466 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -60.62 -40.03 90.4 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.942 -0.572 . . . . 2.56 112.137 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.44 -39.95 85.22 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.288 -0.882 . . . . 2.41 111.595 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -61.53 -51.26 69.32 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.291 -0.881 . . . . 2.82 111.462 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.4 m -157.91 16.13 0.23 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.27 -0.894 . . . . 2.76 112.093 -179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.03 37.74 73.67 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.074 -1.21 . . . . 1.91 110.074 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.47 ' O ' ' O ' ' A' ' 50' ' ' GLU . 97.9 mt-30 -84.73 -24.06 29.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.487 -1.008 . . . . 3.05 110.714 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 49' ' ' GLN . 13.3 pt-20 40.91 175.18 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.628 0 CA-C-O 122.57 1.176 . . . . 2.37 113.924 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.418 ' CD1' HG21 ' A' ' 9' ' ' VAL . 16.6 t80 -69.45 124.45 23.91 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.149 -0.969 . . . . 3.0 110.982 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -70.84 145.85 92.49 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.527 -0.733 . . . . 5.37 109.111 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -75.82 -6.91 18.0 Favored 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.257 1.135 . . . . 3.88 112.996 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.14 32.54 4.06 Favored Glycine 0 N--CA 1.502 3.078 0 C-N-CA 119.559 -1.305 . . . . 3.24 112.767 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.407 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.3 OUTLIER 54.46 179.82 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.529 0 CA-C-N 119.176 1.488 . . . . 4.41 110.288 179.219 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.438 ' HA ' ' CD1' ' A' ' 6' ' ' TYR . 37.8 Cg_endo -69.93 149.98 66.53 Favored 'Trans proline' 0 N--CA 1.488 1.17 0 O-C-N 123.151 1.079 . . . . 4.33 111.063 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo . . . . . 0 C--N 1.321 -0.901 0 O-C-N 123.597 1.314 . . . . 4.82 110.684 -179.479 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.1 t70 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 120.957 0.408 . . . . 3.98 110.054 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.2 m -68.33 -12.59 61.31 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.481 -0.762 . . . . 2.33 110.996 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.08 -35.78 79.69 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.121 -0.987 . . . . 2.22 110.736 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.7 m -55.62 -42.07 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.349 -0.845 . . . . 2.11 110.385 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.458 ' CB ' ' CE2' ' A' ' 43' ' ' TYR . 68.6 mt -60.47 -41.43 94.18 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.499 -0.751 . . . . 2.46 109.603 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -42.8 78.51 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.8 -0.563 . . . . 4.15 110.129 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -59.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.574 -0.704 . . . . 2.09 111.509 -179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -60.08 -56.32 23.05 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.178 -0.951 . . . . 3.44 110.378 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.444 ' CG2' ' CD1' ' A' ' 51' ' ' TYR . 8.6 p -69.32 -38.03 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.401 -0.812 . . . . 1.77 110.128 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -46.43 89.49 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.57 -0.706 . . . . 0.99 111.557 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.6 t -59.98 -47.96 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.548 -0.72 . . . . 1.59 110.383 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.359 -0.838 . . . . 2.4 109.97 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -42.6 -48.53 5.93 Favored Glycine 0 N--CA 1.508 3.48 0 N-CA-C 110.181 -1.168 . . . . 0.41 110.181 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -62.89 -37.36 86.63 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.999 -0.707 . . . . 1.12 111.464 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.21 -39.24 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.156 -0.965 . . . . 1.2 109.702 -179.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.97 -44.8 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 N-CA-C 108.924 -0.769 . . . . 1.34 108.924 178.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -59.99 -41.6 92.38 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 3.65 109.868 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.04 -40.1 95.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 2.23 111.18 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.08 -40.0 92.06 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.411 -0.806 . . . . 1.66 110.86 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.4 tptm -65.69 -42.31 91.35 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.504 -0.747 . . . . 2.58 109.028 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.82 64.38 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.767 -0.827 . . . . 1.25 108.767 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 5.7 mtpp -85.95 8.62 19.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.683 -0.636 . . . . 2.6 110.721 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 27.4 mtpp 59.3 20.09 8.27 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.272 -0.892 . . . . 2.74 111.144 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.99 161.76 8.38 Favored Pre-proline 0 N--CA 1.498 1.945 0 O-C-N 121.506 -0.746 . . . . 1.22 110.137 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.39 165.26 32.26 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.485 1.255 . . . . 1.03 110.912 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -57.0 -31.7 65.36 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.672 -0.642 . . . . 2.52 110.673 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.64 -40.02 82.23 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.571 -0.705 . . . . 2.22 110.507 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -70.13 -41.45 73.89 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.637 -0.664 . . . . 1.46 110.77 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 99.8 t -66.93 -51.27 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.566 -0.709 . . . . 1.37 109.751 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -60.02 -45.6 92.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.758 -0.589 . . . . 1.33 110.758 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.46 75.39 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.311 -0.868 . . . . 1.18 110.36 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.34 -43.5 97.56 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.139 -0.624 . . . . 1.16 110.628 -179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.63 -37.34 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 119.456 -0.898 . . . . 1.28 108.839 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 tppt? -59.97 -39.2 84.83 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.778 0.799 . . . . 3.33 109.207 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -60.0 -45.67 91.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.924 -0.485 . . . . 2.22 110.703 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.06 -35.29 74.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.298 -0.876 . . . . 2.11 110.344 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mp -58.66 -39.77 81.59 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.234 -0.916 . . . . 1.95 109.643 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.6 p -60.01 -40.01 87.81 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 109.095 -0.705 . . . . 1.65 109.095 179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.5 mt -65.16 -47.66 76.27 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.986 -0.746 . . . . 1.34 108.986 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -61.39 -31.57 71.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.148 -0.686 . . . . 2.84 109.148 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.84 -41.5 91.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.698 -0.626 . . . . 1.33 109.419 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.87 -48.64 79.6 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 119.79 -0.764 . . . . 1.9 109.208 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.458 ' CE2' ' CB ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -61.06 -38.51 86.46 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.917 0.865 . . . . 2.85 108.772 178.076 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -60.55 -27.31 67.56 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 116.085 -0.507 . . . . 2.56 111.308 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -55.02 -39.85 69.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.252 -0.905 . . . . 2.41 110.929 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -64.63 -59.85 3.8 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.549 -0.861 . . . . 2.82 110.356 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -165.55 28.89 0.05 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.296 -0.878 . . . . 2.76 111.637 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.98 73.38 0.69 Allowed Glycine 0 N--CA 1.497 2.765 0 N-CA-C 108.994 -1.643 . . . . 1.91 108.994 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.44 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 28.9 mm100 -87.02 -16.42 35.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.634 -0.921 . . . . 3.05 111.984 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 30.26 100.22 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 113.267 0.84 . . . . 2.37 113.267 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.444 ' CD1' ' CG2' ' A' ' 9' ' ' VAL . 32.6 p90 -57.09 140.56 48.92 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.125 -0.984 . . . . 3.0 111.492 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -64.67 164.28 21.67 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.657 -0.652 . . . . 5.37 109.709 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.63 -30.01 18.87 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.397 1.209 . . . . 3.88 111.294 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.2 29.54 5.14 Favored Glycine 0 N--CA 1.496 2.683 0 C-N-CA 119.724 -1.226 . . . . 3.24 111.892 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 52.01 -178.15 0.02 OUTLIER Pre-proline 0 N--CA 1.503 2.19 0 CA-C-N 118.786 1.293 . . . . 4.41 110.484 179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.99 149.97 66.18 Favored 'Trans proline' 0 N--CA 1.49 1.302 0 O-C-N 122.883 0.938 . . . . 4.33 111.44 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo . . . . . 0 C--N 1.318 -1.061 0 O-C-N 123.308 1.162 . . . . 4.82 110.603 -179.212 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.194 0.521 . . . . 3.98 110.276 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.5 p -68.5 -23.06 64.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.615 -0.678 . . . . 2.33 110.306 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.58 -42.87 99.48 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.254 -0.904 . . . . 2.22 109.363 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.5 t -55.42 -44.07 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 N-CA-C 109.348 -0.612 . . . . 2.11 109.348 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.39 -40.5 94.56 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.782 -0.574 . . . . 2.46 110.662 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -59.75 -40.05 86.82 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.498 -0.751 . . . . 4.15 110.463 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -60.16 -40.21 89.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.574 -0.704 . . . . 2.09 110.324 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.92 -49.76 76.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.485 -0.759 . . . . 3.44 111.232 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.413 HG23 ' N ' ' A' ' 10' ' ' ALA . 26.9 m -65.21 -39.95 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 1.77 109.61 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.413 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.57 -38.34 84.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.465 -0.772 . . . . 0.99 110.736 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 72.7 t -60.1 -50.13 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.642 -0.661 . . . . 1.59 110.7 -177.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 -61.87 -50.93 70.25 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.011 -1.056 . . . . 2.4 109.818 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.58 -49.93 4.84 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.974 -1.25 . . . . 0.41 109.974 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.39 -36.8 85.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 122.07 -0.665 . . . . 1.12 111.342 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 68.3 t -59.66 -41.07 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.188 -0.945 . . . . 1.2 109.726 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -59.94 -48.09 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.265 -0.897 . . . . 1.34 108.944 178.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -60.05 -47.6 85.17 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.656 -0.652 . . . . 3.65 110.337 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -62.47 -42.55 99.56 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.589 -0.694 . . . . 2.23 111.192 -178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.7 -40.25 96.32 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.317 -0.865 . . . . 1.66 111.039 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -66.33 -40.23 89.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.637 -0.665 . . . . 2.58 109.882 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -28.12 68.12 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.474 -0.936 . . . . 1.25 108.474 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 62.7 mtpt -84.08 8.77 14.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.854 -0.529 . . . . 2.6 111.002 178.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 95.3 mttt 57.61 27.57 14.4 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 2.74 111.094 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.18 163.43 3.19 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.739 -0.601 . . . . 1.22 110.706 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.9 166.17 27.37 Favored 'Trans proline' 0 C--N 1.315 -1.217 0 O-C-N 123.592 1.312 . . . . 1.03 110.081 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -58.52 -34.33 70.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.671 -0.643 . . . . 2.52 110.811 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.65 -39.79 74.31 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.583 -0.698 . . . . 2.22 110.419 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.86 -46.57 57.47 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.658 -0.651 . . . . 1.46 111.326 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.3 t -69.41 -50.05 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.251 -0.906 . . . . 1.37 111.134 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -59.91 -49.11 78.98 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.454 -0.779 . . . . 1.33 111.277 -178.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.0 -46.21 91.68 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.506 -0.747 . . . . 1.18 110.766 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.31 80.5 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 119.867 -0.733 . . . . 1.16 110.159 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -39.63 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.19 -1.041 . . . . 1.28 108.19 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -61.52 -41.64 97.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.105 -1.072 . . . . 3.33 108.105 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -65.84 -42.84 90.0 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.539 -0.912 . . . . 2.22 108.539 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.04 -40.81 90.66 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 115.952 -0.567 . . . . 2.11 109.719 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 74.4 mt -59.99 -39.71 86.66 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.611 -0.68 . . . . 1.95 109.754 179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.6 t -59.87 -36.62 77.27 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 1.65 109.521 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 82.3 mt -60.05 -51.09 71.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.611 -0.681 . . . . 1.34 110.117 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -60.98 -39.33 89.22 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.527 -0.733 . . . . 2.84 109.627 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.55 91.87 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.766 -0.584 . . . . 1.33 110.487 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -60.79 -49.45 77.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.306 -0.871 . . . . 1.9 109.591 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.37 -38.26 86.36 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.688 -0.632 . . . . 2.85 110.092 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -59.89 -37.78 80.36 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.72 -0.613 . . . . 2.56 110.771 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -57.98 -39.46 78.23 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.423 -0.798 . . . . 2.41 111.25 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -61.21 -54.33 45.57 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.12 -0.988 . . . . 2.82 111.229 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.4 m -156.61 16.47 0.31 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.256 -0.902 . . . . 2.76 111.433 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.74 29.97 68.89 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.48 -1.048 . . . . 1.91 110.48 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' GLU . 91.5 mm-40 -83.95 -23.83 30.94 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.32 -1.106 . . . . 3.05 110.866 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.427 ' O ' ' O ' ' A' ' 49' ' ' GLN . 8.5 pt-20 40.64 -175.1 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 121.805 0.812 . . . . 2.37 112.855 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -66.46 101.96 0.82 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.152 -0.968 . . . . 3.0 110.595 -178.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -69.98 160.04 81.9 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.507 -0.746 . . . . 5.37 109.176 178.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.4 -60.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.178 1.094 . . . . 3.88 111.126 -179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.1 1.2 70.46 Favored Glycine 0 N--CA 1.489 2.223 0 C-N-CA 119.541 -1.314 . . . . 3.24 110.32 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.424 ' N ' ' CD ' ' A' ' 56' ' ' PRO . 7.1 m-20 48.85 49.31 7.3 Favored Pre-proline 0 N--CA 1.499 2.004 0 O-C-N 121.142 -1.21 . . . . 4.41 111.426 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 55' ' ' ASN . 38.1 Cg_endo -69.97 150.06 66.4 Favored 'Trans proline' 0 N--CA 1.486 1.06 0 O-C-N 123.223 1.117 . . . . 4.33 110.451 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo . . . . . 0 C--N 1.317 -1.099 0 O-C-N 123.305 1.161 . . . . 4.82 110.32 179.907 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.017 0.437 . . . . 3.98 110.179 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -71.09 60.37 0.26 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.523 -0.736 . . . . 2.33 110.369 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.6 -49.97 74.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.507 -0.746 . . . . 2.22 110.436 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -60.01 -48.94 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 2.11 110.608 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -45.02 94.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.297 -0.877 . . . . 2.46 110.604 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 33.6 t80 -59.95 -43.5 94.97 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.419 -0.801 . . . . 4.15 110.361 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -60.01 -40.26 88.65 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.516 -0.74 . . . . 2.09 110.736 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -60.01 -50.02 75.37 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.522 -0.736 . . . . 3.44 110.611 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.434 HG21 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -69.72 -40.05 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.12 -0.987 . . . . 1.77 109.253 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.434 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -61.77 -49.99 74.17 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 112.832 0.679 . . . . 0.99 112.832 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.4 m -60.08 -49.01 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.229 -0.92 . . . . 1.59 111.968 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -62.94 -42.61 99.86 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.872 -1.143 . . . . 2.4 109.492 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -43.63 -52.6 6.39 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.695 -1.362 . . . . 0.41 109.695 -179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -62.68 -34.76 77.76 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.926 -0.749 . . . . 1.12 111.221 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 92.0 t -59.62 -40.04 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.29 -0.881 . . . . 1.2 109.584 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.419 ' CG1' ' CG2' ' A' ' 33' ' ' VAL . 55.6 t -59.99 -49.97 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 N-CA-C 108.592 -0.892 . . . . 1.34 108.592 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -64.85 -40.93 95.95 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.37 0.605 . . . . 3.65 110.536 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.0 -48.62 80.96 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.73 -0.606 . . . . 2.23 110.775 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 87.1 mt -59.99 -40.51 89.44 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.643 -0.661 . . . . 1.66 110.41 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 35.0 tptt -69.92 -39.67 76.0 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.618 -0.882 . . . . 2.58 108.618 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.01 -31.72 70.2 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.0 -0.741 . . . . 1.25 109.0 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -92.23 19.4 7.03 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 119.529 -0.869 . . . . 2.6 110.488 178.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.7 mttm 59.6 20.26 8.83 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.451 -0.78 . . . . 2.74 111.678 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.4 158.7 13.82 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.413 -0.805 . . . . 1.22 109.712 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -73.25 167.23 27.85 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.322 1.169 . . . . 1.03 110.153 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -54.96 -24.56 24.52 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.522 -0.736 . . . . 2.52 109.566 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -57.02 -41.86 79.33 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.728 -0.608 . . . . 2.22 110.209 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -75.44 -48.44 22.76 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.685 -0.634 . . . . 1.46 111.32 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.35 -49.54 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 1.37 109.786 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.95 -40.21 88.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.58 -0.7 . . . . 1.33 110.883 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.78 -51.64 68.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.301 -0.874 . . . . 1.18 110.538 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.14 90.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.629 -0.67 . . . . 1.16 109.296 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.419 ' CG2' ' CG1' ' A' ' 16' ' ' VAL . 9.1 t -64.59 -45.67 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 108.455 -0.943 . . . . 1.28 108.455 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -60.01 -40.95 91.02 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.261 -0.899 . . . . 3.33 108.822 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -65.11 -49.4 70.11 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.466 -0.939 . . . . 2.22 108.466 178.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.7 tp -60.0 -39.54 86.12 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 115.821 -0.627 . . . . 2.11 109.689 179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.0 mt -58.22 -38.66 77.26 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.419 -0.8 . . . . 1.95 109.608 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.1 t -60.5 -40.7 92.32 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.607 -0.683 . . . . 1.65 109.475 178.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.4 mt -66.8 -50.95 60.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 109.008 -0.738 . . . . 1.34 109.008 179.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -59.99 -39.89 87.32 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.524 0.678 . . . . 2.84 109.274 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.81 80.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.907 -0.496 . . . . 1.33 110.512 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -60.04 -49.95 75.64 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.289 -0.882 . . . . 1.9 110.236 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.37 -39.96 92.55 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.573 -0.705 . . . . 2.85 110.001 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -60.0 -39.35 85.47 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.758 -0.589 . . . . 2.56 110.484 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -58.79 -37.63 76.77 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.549 -0.72 . . . . 2.41 111.12 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -61.26 -54.48 43.49 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.195 -0.941 . . . . 2.82 111.055 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.16 18.21 0.36 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.113 -0.992 . . . . 2.76 111.659 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.97 33.58 70.28 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 110.466 -1.053 . . . . 1.91 110.466 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -86.72 -13.0 46.62 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.33 -1.1 . . . . 3.05 111.628 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 35.92 -156.03 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 N-CA-C 112.807 0.669 . . . . 2.37 112.807 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -62.88 119.54 9.58 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.17 -0.956 . . . . 3.0 110.552 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.407 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 3.8 mttm -70.13 137.11 86.91 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.665 -0.647 . . . . 5.37 109.485 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -85.06 -170.79 0.82 Allowed 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.178 1.094 . . . . 3.88 110.798 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.61 21.23 78.82 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.767 -0.73 . . . . 3.24 111.287 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.405 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER 55.98 177.8 0.03 OUTLIER Pre-proline 0 N--CA 1.505 2.323 0 O-C-N 121.067 -1.255 . . . . 4.41 110.419 179.475 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.405 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 38.4 Cg_endo -69.99 150.01 66.23 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.313 1.165 . . . . 4.33 109.977 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo . . . . . 0 C--N 1.317 -1.115 0 O-C-N 123.392 1.207 . . . . 4.82 110.746 -178.535 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 36.8 p-10 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.944 0.402 . . . . 3.98 110.346 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -66.35 -20.62 66.13 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.509 -0.745 . . . . 2.33 110.489 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.9 tt -59.95 -41.78 92.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.367 -0.833 . . . . 2.22 110.729 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 p -56.23 -40.88 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 O-C-N 121.272 -0.892 . . . . 2.11 110.461 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -59.79 -40.63 88.99 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.558 -0.714 . . . . 2.46 109.633 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -59.94 -40.12 87.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.611 -0.681 . . . . 4.15 110.016 178.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -61.47 -41.47 97.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.618 -0.676 . . . . 2.09 110.704 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttt85 -59.95 -49.73 76.55 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.541 -0.725 . . . . 3.44 111.101 -178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.43 HG22 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -66.72 -39.83 84.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.437 -0.789 . . . . 1.77 108.93 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.43 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -60.84 -38.57 85.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.797 -0.565 . . . . 0.99 110.97 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.02 -49.95 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.455 -0.778 . . . . 1.59 109.985 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -60.22 -51.91 67.54 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.078 -1.014 . . . . 2.4 109.283 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.01 -58.26 2.34 Favored Glycine 0 N--CA 1.506 3.331 0 N-CA-C 110.68 -0.968 . . . . 0.41 110.68 -178.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.66 -38.52 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.912 -0.758 . . . . 1.12 111.088 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 85.2 t -59.75 -39.96 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.313 -0.867 . . . . 1.2 109.683 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.1 t -60.04 -49.76 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 N-CA-C 108.864 -0.791 . . . . 1.34 108.864 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -59.98 -43.48 95.1 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.72 -0.612 . . . . 3.65 110.103 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.58 -41.55 97.57 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 2.23 111.341 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.35 -42.92 96.76 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.24 -0.913 . . . . 1.66 109.9 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.0 tptp -65.75 -40.0 91.67 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.794 -0.817 . . . . 2.58 108.794 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -26.69 66.72 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.725 -0.842 . . . . 1.25 108.725 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -86.97 10.28 16.85 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.113 -0.635 . . . . 2.6 110.793 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 94.4 mttt 57.35 21.38 6.74 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.294 -0.879 . . . . 2.74 111.091 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.87 162.47 12.22 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.615 -0.678 . . . . 1.22 109.406 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.46 162.69 39.64 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.211 1.111 . . . . 1.03 111.047 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -54.48 -24.45 20.42 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.735 -0.603 . . . . 2.52 110.197 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -59.53 -40.94 88.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.643 -0.661 . . . . 2.22 110.059 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -72.61 -45.61 58.24 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.482 -0.761 . . . . 1.46 110.843 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.1 t -67.02 -50.77 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.553 -0.717 . . . . 1.37 110.305 -179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.3 m-20 -60.13 -43.62 95.54 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.573 -0.705 . . . . 1.33 111.121 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.01 73.47 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.381 -0.824 . . . . 1.18 110.655 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.53 92.59 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 120.261 -0.576 . . . . 1.16 110.492 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -36.57 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.084 -1.08 . . . . 1.28 108.084 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -60.06 -44.13 94.93 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.98 -1.118 . . . . 3.33 107.98 177.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -62.44 -40.03 95.29 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.85 0.833 . . . . 2.22 108.852 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -59.71 -41.5 90.96 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.4 -0.593 . . . . 2.11 109.4 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.4 mt -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.575 -0.703 . . . . 1.95 110.39 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 p -62.12 -27.92 69.27 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.355 -0.841 . . . . 1.65 109.495 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 83.1 mt -66.9 -58.57 4.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.265 -0.897 . . . . 1.34 109.131 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 ptpm? -61.77 -35.53 78.41 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.762 0.791 . . . . 2.84 109.072 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.98 -50.05 75.26 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 116.106 -0.497 . . . . 1.33 109.948 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.34 -40.06 93.16 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.508 -0.745 . . . . 1.9 109.759 179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.432 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -58.98 -39.59 82.22 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.682 -0.636 . . . . 2.85 109.989 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -59.94 -40.04 87.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.604 -0.685 . . . . 2.56 111.046 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.9 -39.25 80.92 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.397 -0.814 . . . . 2.41 111.238 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -64.94 -59.95 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.28 -0.968 . . . . 2.82 110.767 -178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -159.46 12.52 0.14 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.254 -0.904 . . . . 2.76 112.741 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.84 55.23 20.75 Favored Glycine 0 N--CA 1.498 2.821 0 N-CA-C 109.169 -1.573 . . . . 1.91 109.169 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.432 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 97.1 mt-30 -83.22 -20.49 34.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.579 -0.954 . . . . 3.05 111.61 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 30.28 85.8 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.986 0 N-CA-C 112.892 0.701 . . . . 2.37 112.892 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -56.09 147.73 19.51 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.449 -0.782 . . . . 3.0 111.252 -178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -67.08 156.27 88.26 Favored Pre-proline 0 N--CA 1.5 2.063 0 O-C-N 121.587 -0.696 . . . . 5.37 110.572 -179.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.25 -13.62 23.19 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.352 1.185 . . . . 3.88 112.066 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.97 44.95 3.4 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 119.611 -1.28 . . . . 3.24 111.86 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.415 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.4 OUTLIER 53.34 -178.81 0.02 OUTLIER Pre-proline 0 N--CA 1.506 2.349 0 O-C-N 120.946 -1.326 . . . . 4.41 110.328 179.0 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.415 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 37.2 Cg_endo -70.0 150.03 66.18 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.106 1.056 . . . . 4.33 110.373 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo . . . . . 0 C--N 1.319 -1.004 0 O-C-N 123.388 1.204 . . . . 4.82 110.695 -178.841 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 121.069 0.461 . . . . 3.98 110.514 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -62.11 -40.01 94.45 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.617 -0.677 . . . . 2.33 110.736 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp -60.75 -45.83 92.79 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.78 . . . . 2.22 110.114 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 90.5 t -59.22 -40.11 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.836 -0.54 . . . . 2.11 110.425 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.04 -48.8 80.2 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.417 -0.802 . . . . 2.46 110.565 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.42 ' CE2' ' O ' ' A' ' 56' ' ' PRO . 13.3 m-85 -59.88 -39.76 86.38 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.519 -0.738 . . . . 4.15 110.796 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -59.91 -39.46 85.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.419 -0.801 . . . . 2.09 110.171 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.1 mmt-85 -59.93 -50.72 72.66 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.502 -0.749 . . . . 3.44 110.342 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.448 ' HB ' ' CE1' ' A' ' 51' ' ' TYR . 35.5 m -67.79 -40.04 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 C-N-CA 119.48 -0.888 . . . . 1.77 109.348 178.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.402 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -59.96 -36.79 77.86 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.571 -0.706 . . . . 0.99 110.278 178.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.486 -0.759 . . . . 1.59 111.305 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -60.0 -52.62 64.62 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.045 -1.034 . . . . 2.4 110.055 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -42.11 -54.85 4.4 Favored Glycine 0 N--CA 1.508 3.485 0 N-CA-C 110.178 -1.169 . . . . 0.41 110.178 -178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -65.61 -38.3 89.05 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.837 -0.802 . . . . 1.12 111.72 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.68 -40.01 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.219 -0.925 . . . . 1.2 109.233 -178.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.3 t -60.0 -49.99 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.398 -0.814 . . . . 1.34 109.368 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -60.0 -43.36 95.23 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.441 -0.787 . . . . 3.65 109.761 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -60.34 -47.61 85.28 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.756 -0.59 . . . . 2.23 110.772 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.96 -44.04 94.67 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.61 -0.682 . . . . 1.66 110.591 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -65.69 -40.3 92.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.521 -0.737 . . . . 2.58 109.146 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.78 -26.54 68.68 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.499 -0.926 . . . . 1.25 108.499 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 45.6 mtpt -87.74 12.01 13.9 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.754 -0.591 . . . . 2.6 110.644 179.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.8 mtmt 59.8 20.8 9.64 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.383 -0.823 . . . . 2.74 111.195 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.87 161.78 6.18 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.461 -0.774 . . . . 1.22 109.663 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.22 162.1 43.55 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.379 1.2 . . . . 1.03 110.333 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -55.64 -27.35 49.28 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.589 -0.694 . . . . 2.52 110.028 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -59.97 -39.95 87.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.73 -0.607 . . . . 2.22 110.294 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -70.53 -43.12 70.24 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.205 -0.934 . . . . 1.46 110.676 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.36 -51.96 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.485 -0.759 . . . . 1.37 110.047 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 1.33 110.879 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.81 -47.48 83.26 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.382 -0.824 . . . . 1.18 110.399 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.95 84.62 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.09 -0.644 . . . . 1.16 110.279 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.66 -35.93 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.304 -0.998 . . . . 1.28 108.304 179.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -60.08 -42.86 95.49 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.318 -0.993 . . . . 3.33 108.318 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -60.58 -40.0 90.1 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.326 -0.99 . . . . 2.22 108.326 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.85 -44.29 73.84 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.804 -0.634 . . . . 2.11 110.54 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.444 -0.785 . . . . 1.95 109.699 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.0 t -59.87 -32.68 70.94 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.297 -0.631 . . . . 1.65 109.297 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 78.8 mt -65.52 -57.97 6.92 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 120.077 -0.649 . . . . 1.34 109.416 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.02 -33.44 72.0 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.421 -0.799 . . . . 2.84 109.607 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.48 -42.24 91.61 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.267 -0.573 . . . . 1.33 109.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.02 -48.14 82.95 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 107.98 -1.119 . . . . 1.9 107.98 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -60.29 -39.05 85.54 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.723 0.773 . . . . 2.85 109.417 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -60.01 -33.08 71.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.831 -0.543 . . . . 2.56 111.065 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.46 -39.97 71.03 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.463 -0.773 . . . . 2.41 110.14 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.83 -74.93 0.1 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.506 -0.746 . . . . 2.82 109.868 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.3 t -160.05 30.17 0.18 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.473 -0.767 . . . . 2.76 110.241 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.18 68.4 1.65 Allowed Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.517 -1.433 . . . . 1.91 109.517 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -88.41 -26.85 21.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.586 -0.949 . . . . 3.05 111.428 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 31.23 97.56 0.0 OUTLIER 'General case' 0 N--CA 1.519 3.003 0 N-CA-C 112.772 0.656 . . . . 2.37 112.772 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.448 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 46.7 p90 -54.65 139.22 39.41 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.103 -0.998 . . . . 3.0 111.52 -178.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -63.76 169.64 4.05 Favored Pre-proline 0 N--CA 1.498 1.939 0 N-CA-C 109.521 -0.548 . . . . 5.37 109.521 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -64.3 -34.48 55.36 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 122.994 0.997 . . . . 3.88 110.299 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.89 -1.27 87.12 Favored Glycine 0 N--CA 1.492 2.432 0 C-N-CA 119.523 -1.322 . . . . 3.24 110.574 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.0 p30 39.93 50.5 3.39 Favored Pre-proline 0 N--CA 1.507 2.404 0 CA-C-N 117.994 0.897 . . . . 4.41 112.474 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' O ' ' CE2' ' A' ' 6' ' ' TYR . 39.6 Cg_endo -69.98 149.98 66.26 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.087 1.046 . . . . 4.33 110.573 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 N--CA 1.489 1.218 0 O-C-N 123.469 1.247 . . . . 4.82 110.805 179.92 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 121.029 0.442 . . . . 3.98 110.278 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.4 p -65.39 -36.98 85.61 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.584 -0.697 . . . . 2.33 110.303 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.2 tp -60.04 -40.22 88.62 Favored 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 121.68 0.752 . . . . 2.22 109.467 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.18 -44.47 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.984 -0.448 . . . . 2.11 109.945 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.02 -44.93 94.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.431 -0.793 . . . . 2.46 109.496 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -60.06 -41.65 92.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.743 -0.598 . . . . 4.15 111.27 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -60.04 -40.63 90.07 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.472 -0.768 . . . . 2.09 111.213 -178.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.4 mtp180 -60.03 -50.37 73.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.383 -0.823 . . . . 3.44 110.503 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.427 HG23 ' N ' ' A' ' 10' ' ' ALA . 33.1 m -69.67 -40.03 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.754 -0.832 . . . . 1.77 108.754 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.427 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -59.98 -38.46 82.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.708 -0.62 . . . . 0.99 110.554 179.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 30.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.553 -0.717 . . . . 1.59 110.46 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -60.67 -53.58 55.76 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.259 -0.9 . . . . 2.4 109.738 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.32 -55.5 2.48 Favored Glycine 0 N--CA 1.51 3.567 0 N-CA-C 110.632 -0.987 . . . . 0.41 110.632 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -61.95 -38.52 88.8 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.92 -0.753 . . . . 1.12 111.388 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.94 -41.96 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.319 -0.863 . . . . 1.2 109.51 -178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.9 t -60.7 -47.65 92.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 1.34 109.378 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -59.99 -41.14 91.42 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.56 -0.713 . . . . 3.65 110.502 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.95 -40.99 97.69 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.515 -0.74 . . . . 2.23 111.201 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.99 -43.88 94.88 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.347 -0.845 . . . . 1.66 110.656 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -65.15 -39.98 93.72 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.713 -0.847 . . . . 2.58 108.713 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.95 -24.19 66.84 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.71 -0.848 . . . . 1.25 108.71 177.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 87.7 mttt -88.13 10.52 19.04 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 2.6 110.423 178.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.7 mtmt 60.08 19.92 9.14 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.375 -0.828 . . . . 2.74 111.396 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.92 163.42 9.84 Favored Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.562 -0.711 . . . . 1.22 109.968 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.2 160.49 45.16 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.321 1.169 . . . . 1.03 110.392 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -56.91 -29.49 63.08 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.623 -0.673 . . . . 2.52 111.002 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.93 -40.01 75.57 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.36 -0.838 . . . . 2.22 110.688 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -70.51 -43.37 69.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.417 -0.802 . . . . 1.46 110.576 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.7 t -68.41 -47.8 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.637 -0.664 . . . . 1.37 110.648 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -59.97 -44.05 94.68 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.391 -0.818 . . . . 1.33 110.349 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.4 76.2 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.556 -0.715 . . . . 1.18 110.138 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.05 -43.2 96.23 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.647 . . . . 1.16 110.624 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -35.29 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 108.492 -0.929 . . . . 1.28 108.492 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -60.02 -40.04 87.95 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.442 -1.318 . . . . 3.33 107.442 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -60.25 -39.96 88.62 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.209 -1.034 . . . . 2.22 108.209 177.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.98 -45.03 83.24 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 116.033 -0.53 . . . . 2.11 110.173 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -38.34 72.84 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.528 -0.732 . . . . 1.95 109.871 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -61.38 -40.03 92.85 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 109.151 -0.685 . . . . 1.65 109.151 178.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.7 mt -65.99 -55.16 18.15 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.619 -0.882 . . . . 1.34 108.619 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -60.0 -36.49 77.31 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.363 0.602 . . . . 2.84 109.651 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.72 94.79 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.822 -0.549 . . . . 1.33 110.213 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.97 -48.0 83.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.269 -0.894 . . . . 1.9 109.142 178.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.6 -39.96 90.07 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.623 0.725 . . . . 2.85 109.217 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 88.6 tttt -60.05 -38.33 82.5 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.707 -0.62 . . . . 2.56 110.958 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.29 -39.96 80.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.546 -0.721 . . . . 2.41 112.11 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 mttt -61.08 -53.51 56.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.031 -1.043 . . . . 2.82 110.654 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.3 m -156.76 13.91 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.487 -0.758 . . . . 2.76 112.021 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.401 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 70.02 39.41 74.0 Favored Glycine 0 N--CA 1.498 2.814 0 N-CA-C 110.201 -1.16 . . . . 1.91 110.201 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 50' ' ' GLU . 45.4 mt-30 -85.59 -20.13 29.99 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.365 -1.079 . . . . 3.05 111.483 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.535 ' O ' ' O ' ' A' ' 49' ' ' GLN . 15.5 pt-20 42.09 161.92 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.704 1.24 . . . . 2.37 113.853 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -70.14 117.46 11.73 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.872 -1.142 . . . . 3.0 110.711 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.5 mtpp -70.57 149.1 95.46 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.559 -0.713 . . . . 5.37 109.902 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.52 -166.33 0.33 Allowed 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.327 1.172 . . . . 3.88 111.025 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 70.92 18.76 76.47 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.763 -0.935 . . . . 3.24 110.763 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 53.99 175.04 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.178 0 O-C-N 121.254 -1.145 . . . . 4.41 110.822 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.04 150.04 65.97 Favored 'Trans proline' 0 C--N 1.319 -1.008 0 O-C-N 123.093 1.049 . . . . 4.33 110.214 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo . . . . . 0 C--N 1.317 -1.124 0 O-C-N 123.462 1.243 . . . . 4.82 110.614 -179.639 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 120.875 0.369 . . . . 3.98 110.622 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.7 m -70.0 -14.52 62.73 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.414 -0.804 . . . . 2.33 111.194 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.0 tt -61.33 -42.62 98.97 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.207 -0.933 . . . . 2.22 110.685 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.3 p -58.83 -39.4 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.677 -0.639 . . . . 2.11 110.379 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.97 -46.2 88.68 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.733 -0.605 . . . . 2.46 110.426 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -60.0 -40.05 87.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 4.15 110.627 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.4 ' O ' ' CG2' ' A' ' 11' ' ' VAL . 99.5 m-20 -60.22 -40.1 88.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.255 -0.903 . . . . 2.09 110.553 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -60.05 -49.98 75.53 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.452 -0.78 . . . . 3.44 111.083 -179.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.429 HG22 ' N ' ' A' ' 10' ' ' ALA . 32.6 m -67.6 -39.95 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 119.383 -0.927 . . . . 1.77 108.913 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.429 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -61.89 -38.14 87.2 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.708 -0.62 . . . . 0.99 111.276 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.4 ' CG2' ' O ' ' A' ' 7' ' ' ASN . 54.5 t -59.99 -50.02 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.803 . . . . 1.59 110.465 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -60.28 -50.05 75.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.101 -1.04 . . . . 2.4 109.081 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.48 -56.24 3.55 Favored Glycine 0 N--CA 1.509 3.545 0 N-CA-C 110.282 -1.127 . . . . 0.41 110.282 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -61.6 -40.04 93.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.866 -0.785 . . . . 1.12 110.316 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 91.9 t -59.7 -39.26 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.427 -0.796 . . . . 1.2 109.307 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.9 t -59.92 -50.06 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 N-CA-C 108.593 -0.891 . . . . 1.34 108.593 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.1 ttt85 -60.27 -41.42 93.23 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.742 -0.599 . . . . 3.65 110.178 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.6 -39.94 90.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.573 -0.705 . . . . 2.23 110.573 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 86.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.532 -0.73 . . . . 1.66 110.104 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.5 mmtp -69.1 -40.05 78.6 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.574 0.702 . . . . 2.58 109.24 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.08 -33.56 72.24 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.105 -0.702 . . . . 1.25 109.105 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 14.2 ptmt -91.39 17.57 8.31 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.701 -0.8 . . . . 2.6 110.946 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 14.2 mtmt 59.59 22.38 11.04 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.359 -0.838 . . . . 2.74 111.329 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.91 151.55 23.86 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.44 -0.788 . . . . 1.22 110.26 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -69.09 170.71 15.15 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.411 1.216 . . . . 1.03 111.032 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.9 -32.63 67.91 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.195 0.521 . . . . 2.52 110.5 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -59.23 -39.97 84.41 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.6 -0.688 . . . . 2.22 111.169 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -70.16 -40.57 74.66 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.414 -0.804 . . . . 1.46 110.639 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 83.6 t -68.57 -52.17 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.653 -0.654 . . . . 1.37 110.438 -179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.07 -43.85 95.16 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.59 -0.694 . . . . 1.33 110.716 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.03 -47.49 86.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.448 -0.782 . . . . 1.18 110.377 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.54 -44.75 89.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.599 -0.688 . . . . 1.16 110.365 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -38.21 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 108.143 -1.058 . . . . 1.28 108.143 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -60.0 -42.04 93.39 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.126 -1.064 . . . . 3.33 108.126 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -62.94 -47.16 84.42 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.353 -0.981 . . . . 2.22 108.353 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.5 tp -60.01 -41.31 91.89 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.831 -0.622 . . . . 2.11 109.503 178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.19 -38.36 79.64 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.59 -0.694 . . . . 1.95 109.614 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.9 t -60.77 -41.14 94.91 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.089 -0.708 . . . . 1.65 109.089 178.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.4 ' HB3' ' CG1' ' A' ' 9' ' ' VAL . 63.3 mt -63.07 -50.18 71.6 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.467 -0.938 . . . . 1.34 108.467 178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.02 -40.01 87.79 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.653 0.74 . . . . 2.84 109.341 177.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -49.31 78.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.867 -0.521 . . . . 1.33 110.958 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -49.28 78.28 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.215 -0.928 . . . . 1.9 109.979 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.09 -37.01 78.68 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.572 0.701 . . . . 2.85 109.991 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.98 -40.0 87.65 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.681 -0.637 . . . . 2.56 111.297 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.08 -38.25 73.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.464 -0.773 . . . . 2.41 111.257 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.82 -55.17 36.2 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.267 -0.895 . . . . 2.82 110.849 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 29.7 m -158.45 16.85 0.21 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.277 -0.889 . . . . 2.76 111.912 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.87 37.8 75.23 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.433 -1.467 . . . . 1.91 109.433 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' O ' ' A' ' 50' ' ' GLU . 14.3 mm100 -81.5 -29.27 33.69 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.62 -0.93 . . . . 3.05 110.795 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 49' ' ' GLN . 8.5 pt-20 40.56 -172.47 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.505 0.669 . . . . 2.37 112.543 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -70.34 115.42 9.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.169 -0.957 . . . . 3.0 110.857 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -71.25 146.75 92.61 Favored Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.437 -0.789 . . . . 5.37 108.972 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -81.57 -52.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.161 1.085 . . . . 3.88 111.567 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.96 3.36 65.32 Favored Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.657 -1.259 . . . . 3.24 111.395 179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.442 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 13.8 m120 51.81 99.31 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.207 0 CA-C-N 118.724 1.262 . . . . 4.41 111.292 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.459 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 29.5 Cg_endo -59.97 -31.74 94.04 Favored 'Trans proline' 0 CA--C 1.553 1.445 0 O-C-N 123.115 1.061 . . . . 4.33 113.922 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.459 ' HD2' ' N ' ' A' ' 56' ' ' PRO . 47.3 Cg_endo . . . . . 0 N--CA 1.488 1.183 0 CA-C-N 119.83 0.975 . . . . 4.82 110.339 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.7 t0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.186 0.517 . . . . 3.98 110.337 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.7 p -65.69 -39.76 91.61 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.306 -0.871 . . . . 2.33 110.768 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.1 tp -64.79 -55.13 21.59 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.545 -0.722 . . . . 2.22 111.57 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.5 p -59.02 -41.96 84.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.549 -0.719 . . . . 2.11 110.861 -178.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.97 -40.6 89.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.598 -0.689 . . . . 2.46 109.936 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.451 ' CD1' ' HB2' ' A' ' 52' ' ' LYS . 64.9 t80 -60.02 -40.0 87.8 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.479 -0.763 . . . . 4.15 109.883 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -59.97 -40.0 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.476 -0.765 . . . . 2.09 109.804 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -60.03 -50.43 73.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.585 -0.697 . . . . 3.44 111.269 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.0 m -70.02 -40.9 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.225 -0.922 . . . . 1.77 109.575 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.13 -44.69 96.94 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.612 -0.68 . . . . 0.99 111.227 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.3 t -60.06 -46.7 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.384 -0.823 . . . . 1.59 110.362 -178.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -60.03 -49.13 78.88 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.118 -0.989 . . . . 2.4 109.347 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.47 -48.87 3.02 Favored Glycine 0 N--CA 1.51 3.631 0 N-CA-C 110.18 -1.168 . . . . 0.41 110.18 -179.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.38 -34.38 78.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.879 -0.777 . . . . 1.12 110.873 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.71 -43.66 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.284 -0.885 . . . . 1.2 109.264 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.47 -45.51 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 N-CA-C 107.911 -1.144 . . . . 1.34 107.911 177.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -60.32 -40.02 89.11 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 116.04 -0.527 . . . . 3.65 110.879 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.97 -42.5 94.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.48 -0.763 . . . . 2.23 109.93 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.4 -40.18 90.0 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.493 0.663 . . . . 1.66 110.612 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -68.67 -39.99 80.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.392 -0.818 . . . . 2.58 109.052 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -30.86 69.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.073 -0.714 . . . . 1.25 109.073 178.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 17.7 ptpt -94.31 19.33 9.62 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.771 -0.771 . . . . 2.6 110.773 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 2.3 mtpm? 56.9 24.47 9.36 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.423 -0.798 . . . . 2.74 111.082 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.86 59.62 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.66 -0.65 . . . . 1.22 110.369 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.71 159.38 51.44 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.473 1.249 . . . . 1.03 110.684 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -55.17 -27.53 46.34 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.672 -0.642 . . . . 2.52 109.611 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -59.32 -40.12 85.26 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.787 -0.571 . . . . 2.22 110.047 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -70.73 -45.52 64.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.535 -0.728 . . . . 1.46 110.006 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 66.9 t -67.31 -40.49 84.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.737 -0.602 . . . . 1.37 109.801 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -60.07 -49.01 79.34 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.596 -0.69 . . . . 1.33 110.943 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.19 91.14 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.191 -0.943 . . . . 1.18 110.562 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.27 89.02 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 1.16 110.837 -179.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.402 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -66.25 -39.49 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.239 -0.913 . . . . 1.28 108.646 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -60.2 -40.88 91.62 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.173 -1.047 . . . . 3.33 108.173 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -65.72 -44.68 85.3 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.126 -1.064 . . . . 2.22 108.126 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.402 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 14.4 tp -59.06 -48.86 80.07 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 115.54 -0.754 . . . . 2.11 110.176 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -58.4 -37.46 75.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.318 -0.864 . . . . 1.95 109.657 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -59.97 -36.76 77.83 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.545 -0.722 . . . . 1.65 109.339 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.0 mt -59.95 -41.49 91.99 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.505 -0.747 . . . . 1.34 109.283 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 98.3 mttt -62.7 -40.44 97.13 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 120.149 -0.62 . . . . 2.84 109.511 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -40.61 89.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.79 -0.569 . . . . 1.33 110.498 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -60.15 -48.7 80.64 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.517 -0.739 . . . . 1.9 109.639 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -60.04 -40.44 89.39 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 2.85 110.031 179.142 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.428 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 97.9 mttt -62.71 -23.85 67.36 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.725 -0.609 . . . . 2.56 111.979 -179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.07 -39.97 79.87 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.272 -0.893 . . . . 2.41 111.014 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -64.26 -56.14 16.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.538 -0.726 . . . . 2.82 110.657 -179.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -163.21 27.28 0.09 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.461 -0.774 . . . . 2.76 110.804 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.428 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 71.62 41.1 57.92 Favored Glycine 0 N--CA 1.497 2.737 0 C-N-CA 120.012 -1.09 . . . . 1.91 110.387 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.412 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 70.7 mt-30 -83.45 -23.01 32.44 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.31 -1.112 . . . . 3.05 110.897 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 36.7 -157.55 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 112.602 0.593 . . . . 2.37 112.602 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -64.66 123.66 19.89 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.364 -0.835 . . . . 3.0 110.46 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.451 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 51.6 mmtt -68.51 136.81 90.78 Favored Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.529 -0.732 . . . . 5.37 109.424 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -88.96 176.65 3.2 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.167 1.088 . . . . 3.88 111.38 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 70.37 28.86 70.68 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 111.08 -0.808 . . . . 3.24 111.08 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 54.66 178.49 0.03 OUTLIER Pre-proline 0 N--CA 1.506 2.346 0 O-C-N 121.039 -1.271 . . . . 4.41 110.113 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.01 149.98 66.02 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.046 1.024 . . . . 4.33 109.902 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo . . . . . 0 C--N 1.317 -1.095 0 O-C-N 123.334 1.176 . . . . 4.82 110.699 -179.418 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.25 0.548 . . . . 3.98 110.586 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.2 p -66.72 -25.28 66.45 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.669 -0.644 . . . . 2.33 110.597 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.5 tt -60.82 -43.69 97.88 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.406 -0.809 . . . . 2.22 110.005 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 70.0 t -58.8 -49.29 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.864 -0.523 . . . . 2.11 110.062 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.99 -39.99 87.62 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.658 . . . . 2.46 110.625 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -58.68 -40.98 85.14 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.44 -0.787 . . . . 4.15 110.59 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -60.44 -40.38 90.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.612 -0.68 . . . . 2.09 111.421 -179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -59.97 -53.05 62.42 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.284 -0.885 . . . . 3.44 110.738 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.443 ' HB ' ' CE1' ' A' ' 51' ' ' TYR . 28.8 m -69.87 -40.06 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.587 -0.696 . . . . 1.77 109.763 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.15 -43.58 95.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.757 -0.589 . . . . 0.99 111.464 179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.4 t -59.96 -49.23 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.422 -0.799 . . . . 1.59 110.406 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -59.98 -50.14 74.92 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.023 -1.048 . . . . 2.4 109.47 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -38.77 -49.47 2.51 Favored Glycine 0 N--CA 1.509 3.521 0 N-CA-C 110.654 -0.978 . . . . 0.41 110.654 -178.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -64.53 -37.6 88.12 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.868 -0.783 . . . . 1.12 110.979 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.94 -40.06 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.407 -0.808 . . . . 1.2 109.815 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 83.1 t -59.92 -50.34 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.938 . . . . 1.34 108.826 178.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -62.53 -40.01 95.41 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.553 0.692 . . . . 3.65 109.783 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.0 tp10 -59.95 -42.44 94.04 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.863 -0.523 . . . . 2.23 111.341 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.95 -44.88 94.12 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.777 0.799 . . . . 1.66 109.928 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -69.97 -37.49 75.81 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.497 -0.927 . . . . 2.58 108.497 178.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.48 70.9 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.708 -0.849 . . . . 1.25 108.708 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 43.8 pttt -93.91 20.93 7.14 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 119.552 -0.859 . . . . 2.6 110.611 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 49.0 mtmt 60.05 20.38 9.54 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.532 -0.73 . . . . 2.74 111.926 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.19 163.06 4.91 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.424 -0.798 . . . . 1.22 110.614 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -76.77 166.52 26.89 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.449 1.236 . . . . 1.03 111.128 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -58.21 -28.27 64.67 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.736 -0.603 . . . . 2.52 111.316 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -57.67 -40.07 78.54 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.143 -0.973 . . . . 2.22 110.423 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -71.84 -39.98 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.68 0.752 . . . . 1.46 109.52 178.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 61.1 t -66.95 -53.36 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-N 116.224 -0.444 . . . . 1.37 110.439 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -59.95 -48.0 83.5 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.567 -0.708 . . . . 1.33 111.269 -179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.98 83.64 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.298 -0.877 . . . . 1.18 110.519 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.43 -40.01 89.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.647 -0.658 . . . . 1.16 110.554 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -40.04 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.489 -0.884 . . . . 1.28 108.73 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.15 -40.29 93.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.046 -1.062 . . . . 3.33 108.364 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -66.12 -47.16 75.06 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.806 -0.812 . . . . 2.22 108.806 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 tp -60.06 -43.73 95.22 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.95 -0.469 . . . . 2.11 110.062 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.1 mt -59.98 -39.13 84.61 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.489 -0.757 . . . . 1.95 109.714 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.6 m -60.0 -39.53 86.09 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.271 -0.641 . . . . 1.65 109.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.9 mt -60.21 -55.45 33.58 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.435 -0.79 . . . . 1.34 109.91 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.91 -38.56 86.15 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.482 -0.762 . . . . 2.84 109.65 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.65 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 120.433 -0.507 . . . . 1.33 110.592 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.13 -50.95 71.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.124 -0.985 . . . . 1.9 109.792 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.437 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -63.54 -39.2 93.8 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.749 0.785 . . . . 2.85 109.801 178.776 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -60.01 -39.29 85.32 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.872 -0.518 . . . . 2.56 111.013 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -55.44 -37.77 68.15 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.422 -0.799 . . . . 2.41 111.023 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -63.07 -56.4 17.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.253 -0.905 . . . . 2.82 111.322 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.5 m -157.14 18.14 0.29 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.295 -0.878 . . . . 2.76 111.848 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.76 52.25 30.53 Favored Glycine 0 N--CA 1.496 2.655 0 N-CA-C 108.679 -1.769 . . . . 1.91 108.679 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.437 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 90.3 mm-40 -76.63 -37.64 56.01 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.888 . . . . 3.05 111.472 -178.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 32.7 96.83 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.963 0 N-CA-C 112.711 0.634 . . . . 2.37 112.711 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.443 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 41.0 p90 -55.66 143.97 28.5 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.911 -1.118 . . . . 3.0 110.467 -179.041 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.61 157.65 77.84 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.665 -0.647 . . . . 5.37 110.967 -178.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -70.49 -7.18 20.67 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.586 1.309 . . . . 3.88 111.46 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.99 1.96 77.27 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 119.82 -1.181 . . . . 3.24 111.405 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 55.8 174.72 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.251 0 O-C-N 120.984 -1.303 . . . . 4.41 110.801 179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.02 150.04 66.09 Favored 'Trans proline' 0 N--CA 1.487 1.116 0 O-C-N 123.522 1.275 . . . . 4.33 110.567 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.487 1.105 0 O-C-N 123.464 1.244 . . . . 4.82 110.682 -179.583 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 120.89 0.376 . . . . 1.69 110.534 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.97 -49.93 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.327 -0.858 . . . . 1.52 109.626 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 5' ' ' LEU . 4.5 mm? -60.0 -33.3 71.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.468 -0.77 . . . . 1.92 109.214 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -48.61 79.61 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.473 0.654 . . . . 3.87 110.069 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.786 ' O ' HG23 ' A' ' 11' ' ' VAL . 31.2 m120 -61.78 -40.04 93.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.724 -0.61 . . . . 1.35 112.017 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.414 ' HG2' HD13 ' A' ' 39' ' ' LEU . 41.7 ttt180 -59.98 -51.69 68.6 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.26 -0.9 . . . . 2.93 111.7 -177.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.421 HG13 ' N ' ' A' ' 10' ' ' ALA . 11.5 p -66.87 -40.0 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.126 -0.984 . . . . 1.07 109.389 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.421 ' N ' HG13 ' A' ' 9' ' ' VAL . . . -59.94 -40.92 90.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.737 -0.602 . . . . 0.42 111.081 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.7 t -60.28 -50.02 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.464 -0.772 . . . . 0.95 110.644 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -62.85 -51.79 65.65 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.17 -0.957 . . . . 1.84 109.739 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.1 -51.6 2.73 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.593 -1.003 . . . . 0.36 110.593 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -64.55 -39.02 92.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.899 -0.765 . . . . 1.12 111.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 11' ' ' VAL . 75.8 t -59.79 -42.75 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.345 -0.847 . . . . 0.46 109.693 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.427 HG21 ' HA ' ' A' ' 33' ' ' VAL . 54.5 t -60.01 -48.98 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.7 109.819 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.0 -42.31 94.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.719 -0.613 . . . . 3.15 110.622 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -61.26 -48.26 82.27 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.605 -0.685 . . . . 2.23 111.244 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.2 mt -60.0 -42.11 93.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.675 -0.64 . . . . 1.02 111.298 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' CD ' HG21 ' A' ' 29' ' ' VAL . 30.4 tptt -63.99 -40.02 95.42 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.479 -0.934 . . . . 2.08 108.479 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.48 67.71 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.607 -0.886 . . . . 0.81 108.607 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 36.1 mtpt -85.08 8.92 16.29 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.741 -0.599 . . . . 2.11 110.986 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 55.7 mtmt 58.64 21.54 8.87 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.204 -0.935 . . . . 2.28 110.894 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -57.66 166.46 1.8 Allowed Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.562 -0.711 . . . . 0.71 110.418 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 43.5 Cg_endo -68.76 161.26 46.19 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.436 1.23 . . . . 0.93 110.207 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -56.84 -29.53 62.92 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.557 -0.715 . . . . 2.0 110.63 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.66 -39.88 85.9 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.533 -0.73 . . . . 2.22 110.988 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.07 -44.57 68.86 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 1.46 110.589 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.507 HG21 ' CD ' ' A' ' 20' ' ' LYS . 96.9 t -68.6 -48.56 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.713 -0.617 . . . . 0.65 110.256 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.5 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.9 m-20 -60.04 -49.49 77.45 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.509 -0.744 . . . . 1.33 111.503 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.77 84.21 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.14 -0.975 . . . . 0.46 110.427 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -64.76 -41.13 96.13 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 120.296 -0.561 . . . . 0.39 110.803 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.07 -37.13 79.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.257 -1.016 . . . . 0.57 108.257 179.903 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.24 -40.08 88.99 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.924 -0.769 . . . . 2.82 108.924 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.37 -50.68 72.64 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.883 -0.511 . . . . 1.73 110.219 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.483 HD12 ' C ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -60.21 -38.42 83.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.605 -0.684 . . . . 1.53 109.669 179.431 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.57 HD23 ' HE2' ' A' ' 40' ' ' LYS . 12.7 mt -58.0 -41.31 82.79 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.541 -0.724 . . . . 1.36 109.986 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.8 m -60.27 -39.98 88.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.577 -0.702 . . . . 1.31 109.326 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.414 HD13 ' HG2' ' A' ' 8' ' ' ARG . 43.2 mt -67.82 -43.21 80.12 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.007 -0.677 . . . . 0.72 109.279 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.57 ' HE2' HD23 ' A' ' 37' ' ' LEU . 36.5 ttpt -60.01 -39.19 84.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.74 -0.6 . . . . 2.38 109.921 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -42.16 91.93 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.262 -0.575 . . . . 0.69 110.453 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.14 -41.39 98.22 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.332 -0.855 . . . . 1.9 109.875 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -40.46 89.58 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.953 0.882 . . . . 2.03 109.541 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -60.03 -34.17 73.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.905 -0.497 . . . . 2.12 111.177 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -56.1 -40.01 73.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.563 -0.711 . . . . 2.41 111.834 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -62.2 -57.83 10.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.085 -1.009 . . . . 2.31 111.329 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.3 m -156.21 25.16 0.36 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.135 -0.978 . . . . 2.51 111.155 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.95 36.27 64.95 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.607 -0.997 . . . . 1.86 110.607 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -85.18 -15.85 42.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.402 -1.058 . . . . 2.7 111.43 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 38.05 -166.37 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.009 0.744 . . . . 2.37 113.009 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.4 ' CD1' HG22 ' A' ' 9' ' ' VAL . 45.3 t80 . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.184 -0.948 . . . . 2.77 110.207 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 121.281 0.562 . . . . 1.69 110.393 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 86.9 t -59.95 -45.53 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.68 -0.638 . . . . 1.52 110.655 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 86.9 mt -59.96 -39.95 87.35 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.374 -0.829 . . . . 1.92 109.868 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' A' ' 51' ' ' TYR . 2.5 m-85 -57.63 -38.54 75.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.685 -0.634 . . . . 3.87 109.947 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.816 ' O ' HG23 ' A' ' 11' ' ' VAL . 96.3 m-20 -60.05 -40.02 88.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.585 -0.697 . . . . 1.35 110.315 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 mtp85 -59.97 -50.99 71.59 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.373 -0.83 . . . . 2.93 110.886 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.783 ' HA ' HD13 ' A' ' 39' ' ' LEU . 25.1 m -69.54 -38.09 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 108.238 -1.023 . . . . 1.07 108.238 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.07 -39.33 85.66 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 116.098 -0.501 . . . . 0.42 110.543 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.6 t -60.03 -50.02 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.378 -0.826 . . . . 0.95 109.96 -179.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.44 -50.22 74.45 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.151 -0.968 . . . . 1.84 109.392 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.67 -55.49 3.23 Favored Glycine 0 N--CA 1.507 3.388 0 N-CA-C 110.143 -1.183 . . . . 0.36 110.143 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -65.0 -35.61 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.934 -0.745 . . . . 1.12 110.854 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 11' ' ' VAL . 86.0 t -60.01 -40.0 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 121.263 -0.898 . . . . 0.46 109.666 -179.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.02 -49.0 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 N-CA-C 108.902 -0.777 . . . . 0.7 108.902 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.8 ttp85 -60.32 -43.12 96.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.866 -0.521 . . . . 3.15 110.444 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.99 -41.7 97.42 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.41 -0.806 . . . . 2.23 111.406 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.76 -40.51 92.74 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.42 -0.8 . . . . 1.02 110.424 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' CD ' HG21 ' A' ' 29' ' ' VAL . 39.7 tptt -67.2 -40.09 86.43 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.127 -0.694 . . . . 2.08 109.127 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.46 -26.26 66.63 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.739 -0.837 . . . . 0.81 108.739 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -86.22 9.18 18.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.725 -0.609 . . . . 2.11 110.391 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 56.7 21.37 5.83 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.279 -0.888 . . . . 2.28 111.073 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.443 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -59.24 163.56 5.99 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.586 -0.696 . . . . 0.71 109.933 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.443 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 42.3 Cg_endo -67.82 162.32 40.08 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 O-C-N 123.484 1.255 . . . . 0.93 111.292 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -55.28 -27.4 46.42 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.754 -0.591 . . . . 2.0 110.258 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -58.66 -40.0 82.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.62 -0.675 . . . . 2.22 110.461 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -71.15 -45.35 63.71 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -0.81 . . . . 1.46 110.869 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.507 HG21 ' CD ' ' A' ' 20' ' ' LYS . 82.5 t -68.55 -50.0 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.497 -0.752 . . . . 0.65 110.164 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.445 ' O ' HG12 ' A' ' 33' ' ' VAL . 71.4 m-20 -59.98 -46.16 90.34 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 1.33 110.871 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.39 82.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.255 -0.903 . . . . 0.46 110.404 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.15 -42.26 89.28 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 120.086 -0.645 . . . . 0.39 110.496 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.505 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -65.93 -39.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 N-CA-C 108.358 -0.978 . . . . 0.57 108.358 179.331 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -61.06 -42.28 98.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.997 -1.112 . . . . 2.82 107.997 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -65.32 -42.45 92.98 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.833 -1.173 . . . . 1.73 107.833 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.505 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 15.4 tp -60.03 -46.63 88.89 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.737 -0.665 . . . . 1.53 110.0 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.42 -38.4 80.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.272 -0.892 . . . . 1.36 109.575 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 t -59.74 -34.51 73.04 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.644 . . . . 1.31 109.633 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.783 HD13 ' HA ' ' A' ' 9' ' ' VAL . 93.0 mt -60.0 -48.91 79.76 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.473 -0.767 . . . . 0.72 109.5 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.93 -39.93 91.28 Favored 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.774 0.797 . . . . 2.38 109.109 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -43.97 94.85 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 116.177 -0.465 . . . . 0.69 110.566 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.97 -50.68 72.81 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.302 -0.874 . . . . 1.9 109.655 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.421 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -64.47 -38.28 90.46 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.814 0.816 . . . . 2.03 109.718 178.591 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.9 tttp -60.0 -39.05 84.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.928 -0.483 . . . . 2.12 111.815 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -54.86 -39.03 68.21 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.386 -0.821 . . . . 2.41 112.003 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -62.58 -60.01 4.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.009 -1.057 . . . . 2.31 111.325 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.9 m -156.26 23.47 0.36 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.287 -0.883 . . . . 2.51 110.876 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.04 63.11 3.6 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 109.385 -1.486 . . . . 1.86 109.385 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 95.7 mm-40 -83.82 -41.5 17.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.495 -1.003 . . . . 2.7 111.823 -179.074 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 8.0 pt-20 33.54 92.14 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.86 0 CA-C-O 121.584 0.706 . . . . 2.37 112.113 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.406 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 53.3 p90 . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.107 -0.995 . . . . 2.77 111.248 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 N--CA 1.496 1.869 0 CA-C-O 121.662 0.744 . . . . 1.69 109.113 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.464 HG13 ' N ' ' A' ' 5' ' ' LEU . 9.9 p -58.02 -40.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 121.354 0.597 . . . . 1.52 110.531 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.464 ' N ' HG13 ' A' ' 4' ' ' VAL . 8.0 tt -60.02 -40.72 90.28 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.373 0.606 . . . . 1.92 110.183 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -59.52 -40.11 86.09 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.888 -0.508 . . . . 3.87 110.369 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.779 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.1 m-20 -63.21 -40.41 97.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 1.35 110.259 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -62.42 -49.63 74.71 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.13 -0.981 . . . . 2.93 112.106 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.933 HG12 ' HB3' ' A' ' 39' ' ' LEU . 26.6 m -64.83 -42.81 95.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.02 -1.05 . . . . 1.07 110.654 -179.104 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.454 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -62.24 -40.76 97.24 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.39 -0.819 . . . . 0.42 111.689 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 7' ' ' ASN . 73.5 t -60.09 -47.68 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.454 -0.779 . . . . 0.95 111.132 -177.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HG3' HD11 ' A' ' 39' ' ' LEU . 30.0 mm100 -60.61 -48.17 82.95 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 119.245 -0.982 . . . . 1.84 109.553 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -38.6 -56.81 1.97 Allowed Glycine 0 N--CA 1.511 3.688 0 N-CA-C 110.175 -1.17 . . . . 0.36 110.175 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.58 -38.49 91.33 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.977 -0.719 . . . . 1.12 111.004 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 11' ' ' VAL . 93.1 t -59.87 -44.4 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.816 . . . . 0.46 109.427 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.548 HG22 ' CB ' ' A' ' 32' ' ' ALA . 63.9 t -59.98 -44.99 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 108.386 -0.968 . . . . 0.7 108.386 177.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -60.45 -41.57 94.35 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.875 -0.515 . . . . 3.15 111.069 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -64.16 -44.51 91.86 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.345 -0.847 . . . . 2.23 111.445 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.32 -41.96 97.88 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.536 -0.727 . . . . 1.02 111.097 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.463 ' CD ' HG21 ' A' ' 29' ' ' VAL . 39.3 tptt -63.93 -40.02 95.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.361 -0.837 . . . . 2.08 108.993 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.8 67.22 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.58 -0.896 . . . . 0.81 108.58 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 66.0 mttm -84.37 7.38 19.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.729 -0.607 . . . . 2.11 110.852 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 25.9 mmtp 59.28 20.14 8.29 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.172 -0.955 . . . . 2.28 110.938 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.76 162.3 9.6 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.613 -0.68 . . . . 0.71 109.822 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.2 166.48 28.0 Favored 'Trans proline' 0 C--N 1.314 -1.237 0 O-C-N 123.33 1.174 . . . . 0.93 111.133 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.1 -26.87 51.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.747 -0.596 . . . . 2.0 111.005 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.6 -40.04 86.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.478 -0.763 . . . . 2.22 110.557 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.45 -45.93 57.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 1.46 110.933 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.463 HG21 ' CD ' ' A' ' 20' ' ' LYS . 88.8 t -63.89 -49.89 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.498 -0.751 . . . . 0.65 109.461 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -60.0 -44.92 94.24 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.742 -0.599 . . . . 1.33 111.025 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -50.03 75.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.405 -0.809 . . . . 0.46 110.564 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.548 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -63.38 -45.92 88.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.659 -0.651 . . . . 0.39 110.21 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -35.63 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.28 -1.007 . . . . 0.57 108.28 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -59.94 -43.93 94.68 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.45 -0.944 . . . . 2.82 108.45 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? -64.37 -47.44 79.28 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.356 -0.979 . . . . 1.73 108.356 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 tp -59.95 -40.4 88.87 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 115.613 -0.722 . . . . 1.53 110.032 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.6 mt -59.56 -37.41 78.4 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.538 -0.726 . . . . 1.36 109.919 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.7 m -59.84 -40.11 87.42 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.556 -0.715 . . . . 1.31 109.522 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.933 ' HB3' HG12 ' A' ' 9' ' ' VAL . 54.7 mt -63.95 -54.84 28.24 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.036 -0.727 . . . . 0.72 109.036 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.85 -34.65 74.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.565 0.698 . . . . 2.38 109.404 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.454 ' HA ' ' HG2' ' A' ' 44' ' ' LYS . . . -59.88 -38.78 83.19 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.845 -0.535 . . . . 0.69 110.299 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -40.82 84.59 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.24 -0.913 . . . . 1.9 109.884 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -60.39 -45.93 91.8 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.584 -0.698 . . . . 2.03 111.389 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 41' ' ' ALA . 1.0 OUTLIER -61.38 -19.12 61.52 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.327 -0.858 . . . . 2.12 112.034 -178.487 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -59.35 -39.98 84.96 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.365 -0.834 . . . . 2.41 110.745 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.23 -57.42 10.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.575 -0.703 . . . . 2.31 111.092 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.555 ' O ' HG22 ' A' ' 47' ' ' THR . 40.2 m -151.51 19.29 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.236 -0.915 . . . . 2.51 110.776 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.4 39.31 80.68 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.656 -1.378 . . . . 1.86 109.656 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 50' ' ' GLU . 96.6 mm-40 -90.2 -15.39 31.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.606 -0.937 . . . . 2.7 112.2 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' O ' ' A' ' 49' ' ' GLN . 14.8 pt-20 39.75 -176.33 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.608 0 N-CA-C 113.274 0.842 . . . . 2.37 113.274 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.9 t80 . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.944 -1.098 . . . . 2.77 110.724 -179.577 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.6 tp . . . . . 0 N--CA 1.498 1.972 0 CA-C-O 121.505 0.669 . . . . 1.69 109.807 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.75 -46.66 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 C-N-CA 120.441 -0.503 . . . . 1.52 109.872 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -42.51 93.31 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.313 -0.867 . . . . 1.92 109.343 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.495 ' O ' HG22 ' A' ' 9' ' ' VAL . 4.5 t80 -59.89 -39.93 87.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.67 -0.644 . . . . 3.87 110.15 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.733 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.5 m-20 -60.03 -39.98 87.76 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.29 -0.882 . . . . 1.35 110.286 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -59.99 -47.3 86.37 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.689 -0.632 . . . . 2.93 110.892 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.885 ' HA ' HD13 ' A' ' 39' ' ' LEU . 33.1 m -69.12 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.122 -0.986 . . . . 1.07 109.434 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.527 -0.733 . . . . 0.42 110.486 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 7' ' ' ASN . 52.4 t -59.96 -49.04 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.737 -0.602 . . . . 0.95 110.756 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.508 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -60.02 -50.09 75.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.479 -0.763 . . . . 1.84 109.577 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.645 ' HA2' HD13 ' A' ' 36' ' ' LEU . . . -41.93 -55.01 4.23 Favored Glycine 0 N--CA 1.507 3.368 0 N-CA-C 110.49 -1.044 . . . . 0.36 110.49 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -63.34 -35.26 79.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.844 -0.797 . . . . 1.12 111.923 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 11' ' ' VAL . 72.5 t -59.99 -43.58 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.23 -0.919 . . . . 0.46 109.828 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.687 HG11 HG23 ' A' ' 33' ' ' VAL . 62.5 t -59.99 -44.53 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.457 -0.777 . . . . 0.7 109.597 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.675 -0.641 . . . . 3.15 110.806 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.01 -44.03 94.82 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.441 -0.787 . . . . 2.23 111.414 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.495 HD23 ' HB3' ' A' ' 28' ' ' ASP . 4.6 mp -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.328 -0.858 . . . . 1.02 110.337 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.594 ' CD ' HG21 ' A' ' 29' ' ' VAL . 10.7 tptt -62.58 -39.97 95.38 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.196 -0.668 . . . . 2.08 109.196 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.3 -25.48 67.14 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.583 -0.895 . . . . 0.81 108.583 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.29 6.86 24.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.747 -0.596 . . . . 2.11 110.399 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 55.41 25.82 8.11 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.231 -0.918 . . . . 2.28 110.812 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.601 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -58.47 170.33 0.81 Allowed Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.761 -0.587 . . . . 0.71 110.061 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.601 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 45.4 Cg_endo -71.26 154.85 61.42 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.33 1.174 . . . . 0.93 110.012 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -54.47 -24.79 21.78 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.36 -0.837 . . . . 2.0 111.159 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.521 -0.737 . . . . 2.22 110.438 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.495 ' HB3' HD23 ' A' ' 19' ' ' LEU . 68.4 m-20 -72.6 -46.44 54.23 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.457 -0.777 . . . . 1.46 110.974 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.594 HG21 ' CD ' ' A' ' 20' ' ' LYS . 97.8 t -66.04 -49.72 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.648 -0.657 . . . . 0.65 110.608 -179.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.478 ' O ' HG12 ' A' ' 33' ' ' VAL . 75.1 m-20 -59.93 -50.92 71.87 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.388 -0.82 . . . . 1.33 111.625 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.46 90.02 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.038 -1.039 . . . . 0.46 110.399 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.5 ' HB1' HG22 ' A' ' 16' ' ' VAL . . . -65.3 -39.98 93.19 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 120.319 -0.552 . . . . 0.39 110.766 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.687 HG23 HG11 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -68.45 -38.89 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.217 -0.927 . . . . 0.57 109.26 179.594 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -60.0 -35.29 74.72 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.754 0.788 . . . . 2.82 109.113 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -59.95 -40.05 87.66 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.408 0.623 . . . . 1.73 109.587 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.645 HD13 ' HA2' ' A' ' 13' ' ' GLY . 35.3 mt -59.25 -40.03 84.69 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 120.115 -0.634 . . . . 1.53 109.706 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.499 HD12 ' N ' ' A' ' 37' ' ' LEU . 9.7 mp -58.99 -34.67 72.1 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.477 -0.764 . . . . 1.36 109.619 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 26.6 t -59.96 -39.98 87.46 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.903 -0.777 . . . . 1.31 108.903 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.885 HD13 ' HA ' ' A' ' 9' ' ' VAL . 92.2 mt -59.95 -49.98 75.53 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.629 -0.878 . . . . 0.72 108.629 178.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -62.2 -33.03 73.77 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.916 -0.772 . . . . 2.38 108.916 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 38' ' ' SER . . . -60.03 -43.01 95.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.69 109.748 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -61.26 -44.22 97.6 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.231 -1.026 . . . . 1.9 108.231 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.61 -41.2 94.34 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.545 0.688 . . . . 2.03 109.859 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -60.0 -36.35 77.0 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.714 -0.616 . . . . 2.12 111.486 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -56.27 -40.02 73.58 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.322 -0.861 . . . . 2.41 110.745 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.09 -62.83 1.23 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.701 -0.8 . . . . 2.31 110.795 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.2 t -165.78 29.39 0.05 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.303 -0.873 . . . . 2.51 111.613 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.05 63.87 3.42 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 109.136 -1.586 . . . . 1.86 109.136 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 99.6 mt-30 -83.11 -32.15 26.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.656 -0.909 . . . . 2.7 110.462 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 15.2 pt-20 32.31 98.48 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 113.38 0.881 . . . . 2.37 113.38 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.2 p90 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.148 -0.97 . . . . 2.77 110.513 -179.848 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.659 0.742 . . . . 1.69 109.82 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.03 -41.93 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.928 -0.483 . . . . 1.52 111.146 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -59.98 -47.97 83.65 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.317 -0.864 . . . . 1.92 110.149 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.463 ' O ' HG22 ' A' ' 9' ' ' VAL . 8.1 m-85 -57.42 -38.31 74.16 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.522 -0.736 . . . . 3.87 110.418 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.741 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.6 m-20 -60.01 -40.08 88.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.522 -0.736 . . . . 1.35 110.563 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -60.02 -48.89 79.83 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.457 -0.777 . . . . 2.93 110.835 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.848 HG12 ' HB3' ' A' ' 39' ' ' LEU . 30.6 m -65.77 -39.92 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 C-N-CA 119.327 -0.949 . . . . 1.07 109.715 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -40.54 98.06 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.493 -0.754 . . . . 0.42 110.55 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 7' ' ' ASN . 65.8 t -60.66 -42.72 92.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.655 -0.653 . . . . 0.95 110.777 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -62.89 -56.44 17.29 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.132 -0.98 . . . . 1.84 109.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -37.71 -52.74 1.93 Allowed Glycine 0 N--CA 1.512 3.763 0 N-CA-C 110.717 -0.953 . . . . 0.36 110.717 -178.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -61.71 -38.73 88.94 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.976 -0.72 . . . . 1.12 110.941 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 11' ' ' VAL . 97.7 t -59.96 -40.18 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.324 -0.86 . . . . 0.46 110.023 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.416 HG22 ' HB3' ' A' ' 32' ' ' ALA . 71.8 t -60.04 -49.96 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 121.024 -1.047 . . . . 0.7 108.805 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 68.1 ttt-85 -60.07 -44.44 94.75 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 121.459 0.647 . . . . 3.15 110.167 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.14 -48.31 82.26 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.81 -0.556 . . . . 2.23 110.737 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.97 -46.07 90.62 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 120.043 -0.663 . . . . 1.02 110.105 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -66.31 -39.99 89.65 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.414 -0.958 . . . . 2.08 108.414 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.73 -30.55 70.84 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 108.675 -0.861 . . . . 0.81 108.675 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -85.6 10.72 12.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.44 -0.504 . . . . 2.11 110.873 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt 59.91 20.14 9.13 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.302 -0.874 . . . . 2.28 111.195 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -59.4 165.19 4.18 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.554 -0.716 . . . . 0.71 109.953 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 45.3 Cg_endo -70.61 160.55 49.08 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.32 1.168 . . . . 0.93 111.349 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.497 ' HA ' HG12 ' A' ' 29' ' ' VAL . 33.9 mtpt -55.83 -25.71 43.12 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.574 -0.704 . . . . 2.0 110.446 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -59.98 -39.91 87.3 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.152 -0.968 . . . . 2.22 109.953 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -70.0 -49.63 49.57 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.437 -0.789 . . . . 1.46 111.42 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.497 HG12 ' HA ' ' A' ' 26' ' ' LYS . 8.4 p -65.05 -43.25 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.406 -0.809 . . . . 0.65 110.221 -179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.434 ' O ' HG12 ' A' ' 33' ' ' VAL . 95.6 m-20 -60.03 -41.75 92.89 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.8 -0.562 . . . . 1.33 110.792 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.64 -50.11 72.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.447 -0.783 . . . . 0.46 110.797 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -65.46 -41.52 93.3 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 120.182 -0.607 . . . . 0.39 110.331 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.46 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -67.12 -38.87 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 107.412 -1.329 . . . . 0.57 107.412 178.498 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -60.43 -46.36 90.33 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.342 -0.984 . . . . 2.82 108.342 177.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -64.23 -40.92 97.04 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.095 -1.076 . . . . 1.73 108.095 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.598 ' HA ' HD12 ' A' ' 39' ' ' LEU . 17.2 tp -60.0 -40.33 88.84 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 115.626 -0.715 . . . . 1.53 110.322 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.54 HD23 ' HD3' ' A' ' 40' ' ' LYS . 77.5 mt -59.96 -40.0 87.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.219 -0.926 . . . . 1.36 109.722 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.3 m -60.44 -37.02 79.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.424 -0.798 . . . . 1.31 109.347 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.848 ' HB3' HG12 ' A' ' 9' ' ' VAL . 88.6 mt -59.98 -56.24 24.1 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.672 -0.643 . . . . 0.72 110.439 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.54 ' HD3' HD23 ' A' ' 37' ' ' LEU . 17.6 ptmt -62.11 -35.88 80.06 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.317 -0.865 . . . . 2.38 109.23 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -60.76 -43.77 97.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.112 -0.495 . . . . 0.69 110.488 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.04 -47.6 85.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.111 -0.993 . . . . 1.9 109.259 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.464 ' CE2' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -61.22 -38.7 87.54 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.498 -0.751 . . . . 2.03 109.042 178.081 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.8 ttpt -60.34 -27.27 67.23 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.749 -0.594 . . . . 2.12 111.081 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -55.6 -37.76 68.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.26 -0.9 . . . . 2.41 110.961 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -62.82 -77.71 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.443 -0.786 . . . . 2.31 110.014 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 t -161.49 40.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.31 -0.869 . . . . 2.51 110.241 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.71 65.75 2.4 Favored Glycine 0 N--CA 1.496 2.698 0 N-CA-C 109.972 -1.251 . . . . 1.86 109.972 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HB3' ' CE2' ' A' ' 43' ' ' TYR . 81.6 mm-40 -86.43 -21.75 26.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.467 -1.019 . . . . 2.7 111.608 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 9.0 pt-20 32.21 92.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 112.811 0.671 . . . . 2.37 112.811 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.2 p90 . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.126 -0.984 . . . . 2.77 110.716 -179.217 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.509 HD23 ' C ' ' A' ' 3' ' ' LEU . 7.9 tt . . . . . 0 N--CA 1.502 2.153 0 N-CA-C 112.474 0.546 . . . . 1.69 112.474 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 5' ' ' LEU . 14.7 p -58.64 -39.5 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.089 -1.007 . . . . 1.52 110.251 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.612 HD12 ' CZ ' ' A' ' 43' ' ' TYR . 0.5 OUTLIER -58.93 -39.96 83.18 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 109.394 -0.595 . . . . 1.92 109.394 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.56 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 m-85 -59.11 -38.26 79.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.614 -0.679 . . . . 3.87 110.103 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.836 ' O ' HG23 ' A' ' 11' ' ' VAL . 58.9 m-20 -60.04 -40.75 90.48 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.14 -0.975 . . . . 1.35 109.938 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -60.01 -49.52 77.32 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.762 -0.586 . . . . 2.93 110.715 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.861 HG12 ' HB3' ' A' ' 39' ' ' LEU . 26.5 m -66.76 -39.46 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.391 -0.818 . . . . 1.07 109.565 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 51' ' ' TYR . . . -60.51 -37.1 80.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.534 -0.728 . . . . 0.42 110.319 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.836 HG23 ' O ' ' A' ' 7' ' ' ASN . 64.2 t -60.01 -49.95 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.625 -0.672 . . . . 0.95 109.76 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.37 -56.13 21.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.353 -0.842 . . . . 1.84 109.876 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -36.42 -52.5 1.35 Allowed Glycine 0 N--CA 1.514 3.866 0 N-CA-C 110.907 -0.877 . . . . 0.36 110.907 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -62.26 -37.93 87.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.884 -0.774 . . . . 1.12 111.289 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 11' ' ' VAL . 76.2 t -59.52 -40.56 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.329 -0.857 . . . . 0.46 109.469 -178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.1 t -59.98 -49.6 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.4 -0.812 . . . . 0.7 109.004 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -60.0 -43.48 95.19 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.581 -0.699 . . . . 3.15 110.423 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -60.4 -39.5 87.57 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.481 -0.762 . . . . 2.23 111.255 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 28' ' ' ASP . 83.1 mt -60.02 -40.5 89.54 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.374 -0.829 . . . . 1.02 110.924 -178.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.522 ' HE2' HG21 ' A' ' 29' ' ' VAL . 14.3 mmtp -66.24 -40.26 90.1 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.35 -0.844 . . . . 2.08 109.326 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.39 66.93 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.171 -1.048 . . . . 0.81 108.171 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 48.7 mtpt -86.33 9.44 17.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.715 -0.616 . . . . 2.11 111.007 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 57.9 mtpt 58.08 24.77 11.6 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.28 -0.888 . . . . 2.28 110.822 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 157.99 40.65 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.777 -0.577 . . . . 0.71 110.3 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.52 167.44 27.03 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.433 1.228 . . . . 0.93 110.478 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -56.63 -31.86 64.76 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.732 -0.605 . . . . 2.0 109.778 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -59.71 -40.05 86.66 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.637 -0.664 . . . . 2.22 110.533 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.478 ' HB3' HD22 ' A' ' 19' ' ' LEU . 63.1 m-20 -69.81 -42.45 73.69 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.291 -0.881 . . . . 1.46 110.049 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.522 HG21 ' HE2' ' A' ' 20' ' ' LYS . 93.8 t -67.68 -48.95 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 CA-C-O 121.39 0.614 . . . . 0.65 109.773 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.427 ' O ' HG12 ' A' ' 33' ' ' VAL . 89.1 m-20 -59.92 -46.87 87.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.658 -0.652 . . . . 1.33 111.198 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.29 -47.72 84.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.333 -0.855 . . . . 0.46 110.758 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.75 -44.99 88.32 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.497 -0.752 . . . . 0.39 110.247 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.444 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -64.47 -38.51 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.031 -1.1 . . . . 0.57 108.031 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.06 -45.5 92.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 108.07 -1.085 . . . . 2.82 108.07 177.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -63.57 -43.15 97.84 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 122.117 0.961 . . . . 1.73 108.604 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 17.4 tp -59.96 -42.44 94.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.833 -0.621 . . . . 1.53 110.096 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.03 -38.72 83.55 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.499 -0.75 . . . . 1.36 110.384 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 p -59.98 -37.57 80.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.365 -0.835 . . . . 1.31 109.337 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.861 ' HB3' HG12 ' A' ' 9' ' ' VAL . 79.7 mt -62.23 -52.93 61.8 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.609 -0.886 . . . . 0.72 108.609 178.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.58 -38.37 84.37 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.42 0.629 . . . . 2.38 109.361 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.39 93.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.757 -0.59 . . . . 0.69 109.762 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -60.08 -44.9 94.43 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.617 -0.882 . . . . 1.9 108.617 178.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.612 ' CZ ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -60.19 -43.34 95.98 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.433 0.635 . . . . 2.03 110.101 178.358 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.54 -29.03 68.88 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.722 -0.611 . . . . 2.12 111.793 -179.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -55.97 -39.97 72.58 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.288 -0.882 . . . . 2.41 111.212 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.31 -64.39 0.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.397 -0.815 . . . . 2.31 110.79 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -165.94 32.79 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.383 -0.823 . . . . 2.51 110.994 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.59 70.58 1.2 Allowed Glycine 0 N--CA 1.498 2.788 0 N-CA-C 110.398 -1.081 . . . . 1.86 110.398 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 50' ' ' GLU . 22.5 mm100 -85.92 -28.01 24.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.537 -0.978 . . . . 2.7 110.405 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.492 ' O ' ' O ' ' A' ' 49' ' ' GLN . 16.2 pt-20 39.47 114.98 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 122.892 1.33 . . . . 2.37 113.088 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.572 ' CD1' HG23 ' A' ' 9' ' ' VAL . 13.9 t80 . . . . . 0 N--CA 1.498 1.949 0 O-C-N 120.844 -1.16 . . . . 2.77 110.668 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 37.5 tp . . . . . 0 N--CA 1.499 1.98 0 CA-C-O 121.123 0.487 . . . . 1.69 110.845 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 5' ' ' LEU . 11.9 p -59.56 -46.36 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.59 -0.694 . . . . 1.52 110.904 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.493 ' N ' HG13 ' A' ' 4' ' ' VAL . 85.0 mt -61.38 -40.03 92.83 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.346 -0.846 . . . . 1.92 109.404 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.492 ' O ' HG22 ' A' ' 9' ' ' VAL . 32.3 t80 -59.93 -39.85 86.93 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.045 -0.724 . . . . 3.87 109.045 178.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.832 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.6 m-20 -60.14 -39.88 87.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.408 -0.807 . . . . 1.35 109.995 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -58.94 -49.97 75.82 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.382 -0.824 . . . . 2.93 110.431 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.861 HG12 ' HB3' ' A' ' 39' ' ' LEU . 28.0 m -68.43 -38.19 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.156 -0.965 . . . . 1.07 108.626 178.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -38.15 81.71 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.745 -0.597 . . . . 0.42 110.346 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.5 t -60.03 -50.38 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.678 -0.639 . . . . 0.95 110.78 -178.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.86 ' HG3' HD11 ' A' ' 39' ' ' LEU . 95.2 mm-40 -61.72 -49.24 77.26 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.202 -0.999 . . . . 1.84 109.923 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -45.04 -48.65 9.65 Favored Glycine 0 N--CA 1.506 3.333 0 N-CA-C 109.561 -1.415 . . . . 0.36 109.561 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -64.04 -35.99 82.52 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.889 -0.771 . . . . 1.12 110.742 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 11' ' ' VAL . 69.4 t -59.01 -40.05 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.414 -0.804 . . . . 0.46 109.809 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.705 HG13 HG13 ' A' ' 29' ' ' VAL . 59.1 t -59.98 -49.72 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 108.247 -1.019 . . . . 0.7 108.247 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -60.04 -45.34 93.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.696 -0.627 . . . . 3.15 110.211 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.94 -40.04 91.75 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.62 -0.675 . . . . 2.23 111.063 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 71.9 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.433 -0.792 . . . . 1.02 110.685 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.738 ' HE3' HG11 ' A' ' 29' ' ' VAL . 13.6 mmtp -63.37 -40.06 96.23 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.164 -0.68 . . . . 2.08 109.164 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.55 -26.39 68.68 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.522 -0.918 . . . . 0.81 108.522 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 76.5 mttt -86.03 8.73 19.49 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.791 -0.568 . . . . 2.11 110.629 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 48.3 mttp 59.31 20.03 8.22 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.308 -0.87 . . . . 2.28 110.545 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.58 155.9 56.97 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.59 -0.694 . . . . 0.71 110.013 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.45 160.36 50.08 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.434 1.229 . . . . 0.93 110.454 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -55.05 -26.49 37.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.498 -0.751 . . . . 2.0 110.53 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -59.95 -40.01 87.52 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.577 -0.702 . . . . 2.22 110.898 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -69.86 -43.12 72.52 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.404 -0.81 . . . . 1.46 111.023 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.738 HG11 ' HE3' ' A' ' 20' ' ' LYS . 90.4 t -68.02 -43.79 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.65 110.287 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.492 ' O ' HG12 ' A' ' 33' ' ' VAL . 85.3 m-20 -59.99 -43.52 95.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -0.754 . . . . 1.33 111.322 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.66 83.96 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.378 -0.826 . . . . 0.46 110.928 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.48 -40.14 95.11 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 120.006 -0.677 . . . . 0.39 110.686 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -68.17 -39.96 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 119.487 -0.885 . . . . 0.57 108.881 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -60.44 -40.95 92.97 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.198 -1.038 . . . . 2.82 108.198 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -62.3 -39.57 93.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.303 -0.999 . . . . 1.73 108.303 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.901 HD22 HD12 ' A' ' 39' ' ' LEU . 1.6 tm? -57.88 -40.01 79.21 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 116.033 -0.53 . . . . 1.53 109.851 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mp -56.77 -39.11 73.46 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.172 -0.955 . . . . 1.36 109.005 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.4 t -59.96 -39.65 86.34 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.87 -0.789 . . . . 1.31 108.87 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.901 HD12 HD22 ' A' ' 36' ' ' LEU . 82.7 mt -64.31 -39.8 94.63 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.935 -0.765 . . . . 0.72 108.935 179.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -59.25 -37.37 77.44 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.805 -0.559 . . . . 2.38 109.593 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.95 -39.99 87.46 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.585 -0.697 . . . . 0.69 109.799 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.53 -41.77 92.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.298 -0.876 . . . . 1.9 109.614 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -60.01 -47.24 86.63 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.653 -0.655 . . . . 2.03 111.782 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.499 ' CB ' ' HA ' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -55.67 -28.75 57.2 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.562 -0.711 . . . . 2.12 111.614 -177.037 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.468 ' N ' ' HG3' ' A' ' 44' ' ' LYS . 58.1 mm-40 -60.02 -39.93 87.58 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.256 -0.903 . . . . 2.41 110.5 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -63.31 -52.78 60.5 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.513 -0.742 . . . . 2.31 112.238 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 m -156.37 -70.92 0.11 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.011 -1.056 . . . . 2.51 112.767 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -86.63 -113.83 0.91 Allowed Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.926 -1.13 . . . . 1.86 113.2 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.499 ' HA ' ' CB ' ' A' ' 44' ' ' LYS . 32.9 mt-30 -140.98 -30.26 0.64 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.994 -0.71 . . . . 2.7 112.87 -176.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -158.02 155.74 29.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.086 -1.009 . . . . 2.37 111.425 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.445 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 51.7 p90 . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.693 -0.629 . . . . 2.77 110.454 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 120.706 0.289 . . . . 1.69 110.511 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 84.5 t -59.93 -49.79 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.201 -0.937 . . . . 1.52 109.094 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.04 -38.12 81.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.639 -0.663 . . . . 1.92 109.927 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -59.98 -40.0 87.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.599 -0.688 . . . . 3.87 110.127 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.6 m120 -60.02 -39.64 86.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.499 -0.751 . . . . 1.35 110.23 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -59.97 -51.11 71.07 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.38 -0.825 . . . . 2.93 110.534 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.603 HG22 ' CD2' ' A' ' 51' ' ' TYR . 8.3 p -69.04 -42.5 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.452 -0.78 . . . . 1.07 109.785 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.416 ' N ' HG13 ' A' ' 9' ' ' VAL . . . -60.05 -47.61 85.15 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.543 -0.723 . . . . 0.42 111.269 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.633 ' O ' HG23 ' A' ' 15' ' ' VAL . 56.1 t -60.02 -48.13 89.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.61 -0.681 . . . . 0.95 110.732 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.24 -55.17 31.02 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.194 -0.941 . . . . 1.84 109.709 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.94 -55.02 2.92 Favored Glycine 0 N--CA 1.508 3.445 0 N-CA-C 111.095 -0.802 . . . . 0.36 111.095 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -63.87 -38.46 91.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.75 -0.853 . . . . 1.12 111.377 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 11' ' ' VAL . 72.6 t -59.46 -40.05 80.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.459 -0.776 . . . . 0.46 109.683 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.538 HG22 ' HB3' ' A' ' 32' ' ' ALA . 54.5 t -59.96 -50.05 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.271 -0.893 . . . . 0.7 108.67 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.6 ttp85 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.604 -0.685 . . . . 3.15 109.967 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -60.11 -45.14 93.96 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.626 -0.671 . . . . 2.23 110.442 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.95 -40.09 87.8 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.401 0.62 . . . . 1.02 110.088 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.694 ' HD2' HG21 ' A' ' 29' ' ' VAL . 2.4 tptm -63.33 -40.15 96.53 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.018 -0.734 . . . . 2.08 109.018 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.44 -27.81 68.78 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.214 -1.032 . . . . 0.81 108.214 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 59.5 mtpt -86.37 9.11 18.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.765 -0.585 . . . . 2.11 110.904 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 56.1 mttm 59.32 22.11 10.44 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.28 -0.887 . . . . 2.28 110.9 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.27 161.09 10.6 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.603 -0.686 . . . . 0.71 110.397 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.12 158.3 52.42 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.462 1.243 . . . . 0.93 110.143 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -55.48 -28.06 52.21 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.501 -0.75 . . . . 2.0 110.448 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -59.33 -41.63 89.56 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.624 -0.672 . . . . 2.22 110.352 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -70.5 -42.78 70.89 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.489 -0.757 . . . . 1.46 110.37 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.694 HG21 ' HD2' ' A' ' 20' ' ' LYS . 65.7 t -68.86 -49.39 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.726 -0.609 . . . . 0.65 110.522 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.416 ' O ' HG12 ' A' ' 33' ' ' VAL . 99.6 m-20 -60.08 -43.23 95.64 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.433 -0.792 . . . . 1.33 111.491 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -49.99 75.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.308 -0.87 . . . . 0.46 110.707 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.538 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -65.32 -41.57 93.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.188 -0.605 . . . . 0.39 110.548 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.416 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.09 -38.44 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 108.262 -1.014 . . . . 0.57 108.262 179.357 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -60.82 -41.21 95.28 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.687 -0.857 . . . . 2.82 108.687 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.1 tp60 -64.69 -41.93 95.68 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.221 -1.029 . . . . 1.73 108.221 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.601 HD13 ' C ' ' A' ' 36' ' ' LEU . 3.1 tm? -60.01 -41.18 91.59 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 116.065 -0.516 . . . . 1.53 110.093 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.9 mt -59.6 -40.01 86.06 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.409 -0.807 . . . . 1.36 109.946 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.6 m -60.08 -39.99 88.01 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.593 -0.692 . . . . 1.31 109.255 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.1 -46.5 80.82 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.453 -0.943 . . . . 0.72 108.453 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -60.04 -40.98 91.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.926 -0.484 . . . . 2.38 110.348 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.05 -40.44 97.7 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.527 -0.733 . . . . 0.69 110.285 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -66.76 -39.98 88.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.52 -0.737 . . . . 1.9 110.037 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -43.62 95.14 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.542 -0.724 . . . . 2.03 109.952 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -63.71 -27.6 69.32 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.668 -0.645 . . . . 2.12 111.81 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -39.57 69.3 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.151 -0.968 . . . . 2.41 110.911 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -62.24 -58.41 7.85 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.568 -0.708 . . . . 2.31 110.276 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.475 HG23 ' HG3' ' A' ' 49' ' ' GLN . 4.4 t -161.43 29.57 0.13 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.461 -0.774 . . . . 2.51 110.377 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.46 47.64 27.37 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.526 -1.03 . . . . 1.86 110.526 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.475 ' HG3' HG23 ' A' ' 47' ' ' THR . 99.5 mt-30 -85.71 -11.43 53.71 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.356 -1.085 . . . . 2.7 111.163 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 35.97 -157.76 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.689 0 N-CA-C 112.519 0.562 . . . . 2.37 112.519 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.603 ' CD2' HG22 ' A' ' 9' ' ' VAL . 33.4 t80 . . . . . 0 N--CA 1.495 1.819 0 O-C-N 121.275 -0.891 . . . . 2.77 109.919 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.609 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 120.639 0.257 . . . . 1.69 111.197 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.566 HG23 HD12 ' A' ' 5' ' ' LEU . 29.6 m -54.93 -43.42 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.212 -0.93 . . . . 1.52 110.622 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.566 HD12 HG23 ' A' ' 4' ' ' VAL . 2.3 mp -60.9 -40.1 91.81 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.453 -0.779 . . . . 1.92 109.69 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.496 ' O ' HG22 ' A' ' 9' ' ' VAL . 5.4 t80 -59.66 -39.37 84.2 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.542 0.687 . . . . 3.87 110.028 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.746 ' O ' HG23 ' A' ' 11' ' ' VAL . 24.6 m120 -59.97 -39.34 85.32 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.756 . . . . 1.35 110.048 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.4 mmm-85 -60.01 -49.91 75.8 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.768 . . . . 2.93 110.519 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.763 HG12 ' HB3' ' A' ' 39' ' ' LEU . 32.9 m -67.19 -40.07 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 C-N-CA 119.235 -0.986 . . . . 1.07 108.417 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.96 93.2 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.756 -0.59 . . . . 0.42 111.437 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 7' ' ' ASN . 39.6 t -59.99 -52.16 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.481 -0.762 . . . . 0.95 111.411 -178.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.492 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 96.5 mm-40 -60.17 -47.28 86.6 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.242 -0.911 . . . . 1.84 110.477 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.516 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -41.54 -52.59 4.47 Favored Glycine 0 N--CA 1.509 3.531 0 N-CA-C 109.936 -1.266 . . . . 0.36 109.936 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -65.97 -37.04 84.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 122.122 -0.634 . . . . 1.12 111.256 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 11' ' ' VAL . 93.3 t -60.02 -40.31 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.315 -0.866 . . . . 0.46 109.689 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.04 -49.91 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 108.878 -0.786 . . . . 0.7 108.878 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.57 -43.0 97.77 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.612 -0.68 . . . . 3.15 110.784 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -61.63 -44.24 97.36 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.408 -0.807 . . . . 2.23 111.084 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 85.9 mt -60.04 -39.97 87.76 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.427 0.632 . . . . 1.02 110.464 -179.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -65.98 -39.99 90.83 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.253 0.549 . . . . 2.08 109.571 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.55 66.85 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 108.918 -0.771 . . . . 0.81 108.918 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' HE2' ' HA ' ' A' ' 19' ' ' LEU . 9.1 mtmt -86.69 10.14 16.64 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.614 -0.835 . . . . 2.11 111.001 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 58.85 21.99 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.228 -0.92 . . . . 2.28 110.812 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.498 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -58.68 160.33 10.63 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.516 -0.74 . . . . 0.71 109.944 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.38 167.77 26.37 Favored 'Trans proline' 0 C--N 1.316 -1.168 0 O-C-N 123.359 1.189 . . . . 0.93 109.838 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -53.92 -22.65 10.6 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.544 -0.722 . . . . 2.0 110.364 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -55.74 -45.71 77.94 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.54 -0.725 . . . . 2.22 110.27 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.498 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 98.2 m-20 -72.22 -40.9 67.46 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.546 -0.721 . . . . 1.46 111.113 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 55.9 t -68.29 -47.61 77.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.488 -0.758 . . . . 0.65 110.214 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.446 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.8 m-20 -59.94 -46.43 89.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.715 . . . . 1.33 110.951 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.47 -49.96 73.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.406 -0.809 . . . . 0.46 110.649 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.58 -42.47 95.6 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.042 -0.663 . . . . 0.39 110.358 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -67.64 -37.84 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.465 -0.939 . . . . 0.57 108.465 179.445 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 37' ' ' LEU . 85.5 tttt -59.97 -37.87 80.86 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.902 0.858 . . . . 2.82 108.881 178.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -60.0 -41.56 92.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.936 -0.477 . . . . 1.73 109.761 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.516 HD11 ' HA2' ' A' ' 13' ' ' GLY . 22.6 mt -59.15 -39.97 84.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.837 -0.539 . . . . 1.53 110.771 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 34' ' ' LYS . 84.4 mt -58.32 -40.58 82.45 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.519 -0.738 . . . . 1.36 110.032 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.5 m -62.35 -39.99 94.94 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.744 -0.783 . . . . 1.31 109.644 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HG12 ' A' ' 9' ' ' VAL . 25.6 mt -66.9 -51.49 54.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.644 . . . . 0.72 109.379 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -60.72 -39.96 90.54 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.753 -0.592 . . . . 2.38 109.735 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.1 -42.51 94.82 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.885 -0.509 . . . . 0.69 111.042 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -70.03 -43.15 71.88 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.324 -0.86 . . . . 1.9 110.749 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.429 ' CD1' ' CB ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -62.02 -49.02 77.69 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 2.03 112.352 -179.335 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -59.7 -23.16 62.9 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.225 -0.922 . . . . 2.12 111.429 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -60.04 -39.99 87.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.418 -0.801 . . . . 2.41 110.807 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.99 -60.06 2.79 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.374 -0.93 . . . . 2.31 110.561 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.545 HG22 ' O ' ' A' ' 47' ' ' THR . 32.7 m -160.18 45.29 0.22 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.148 -0.97 . . . . 2.51 111.868 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.38 42.08 96.17 Favored Glycine 0 N--CA 1.5 2.911 0 N-CA-C 109.073 -1.611 . . . . 1.86 109.073 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.429 ' CB ' ' CD1' ' A' ' 43' ' ' TYR . 93.8 mt-30 -96.76 28.35 3.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.703 -0.88 . . . . 2.7 110.939 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -52.41 178.44 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.712 -0.617 . . . . 2.37 110.849 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.1 t80 . . . . . 0 N--CA 1.5 2.059 0 O-C-N 121.541 -0.724 . . . . 2.77 111.519 -178.351 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.8 tp . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 121.4 0.619 . . . . 1.69 109.872 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.4 t -59.82 -41.06 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.88 -0.513 . . . . 1.52 110.421 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 mt -60.01 -43.5 95.19 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.251 -0.906 . . . . 1.92 109.843 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.02 -39.11 84.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.611 -0.68 . . . . 3.87 109.75 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.734 ' O ' HG13 ' A' ' 11' ' ' VAL . 30.8 m120 -60.99 -40.64 94.27 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 1.35 110.719 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.7 -50.39 73.67 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.298 -0.876 . . . . 2.93 110.956 -179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.763 HG12 ' HB3' ' A' ' 39' ' ' LEU . 17.5 m -70.14 -40.57 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 1.07 108.472 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.438 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.84 -50.54 73.01 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 112.89 0.7 . . . . 0.42 112.89 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.734 HG13 ' O ' ' A' ' 7' ' ' ASN . 32.8 m -60.2 -45.2 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.169 -0.957 . . . . 0.95 111.827 -177.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.53 ' HG3' HD11 ' A' ' 39' ' ' LEU . 29.5 mm100 -60.15 -50.39 73.88 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.049 -1.032 . . . . 1.84 110.372 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.606 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -45.79 -41.69 10.34 Favored Glycine 0 N--CA 1.507 3.372 0 N-CA-C 109.302 -1.519 . . . . 0.36 109.302 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -66.16 -37.44 85.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 122.097 -0.649 . . . . 1.12 110.908 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.1 t -60.01 -40.87 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.53 -0.731 . . . . 0.46 110.012 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.453 HG22 ' CB ' ' A' ' 32' ' ' ALA . 61.5 t -60.69 -46.36 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.281 -0.887 . . . . 0.7 109.045 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -59.95 -40.06 87.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.571 -0.705 . . . . 3.15 110.654 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -59.99 -42.82 95.06 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.546 -0.721 . . . . 2.23 110.059 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.03 -40.03 87.92 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.752 -0.592 . . . . 1.02 110.577 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.582 ' HE2' HG11 ' A' ' 29' ' ' VAL . 46.8 mmtt -60.63 -44.19 96.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.33 -0.856 . . . . 2.08 109.093 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.26 68.55 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.312 -0.996 . . . . 0.81 108.312 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -85.48 8.21 19.95 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.761 -0.587 . . . . 2.11 110.764 179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt 58.46 21.61 8.67 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.242 -0.911 . . . . 2.28 110.755 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.61 148.68 80.91 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.633 -0.667 . . . . 0.71 110.183 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -70.36 168.2 23.03 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.418 1.22 . . . . 0.93 110.898 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.3 mmmt -55.92 -30.74 62.1 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.811 -0.555 . . . . 2.0 110.84 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -59.09 -40.02 83.98 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.498 -0.751 . . . . 2.22 110.532 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -71.48 -44.07 65.43 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.433 -0.792 . . . . 1.46 110.478 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.582 HG11 ' HE2' ' A' ' 20' ' ' LYS . 94.2 t -69.08 -40.58 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.69 -0.631 . . . . 0.65 110.328 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.454 ' O ' HG12 ' A' ' 33' ' ' VAL . 87.3 m-20 -59.27 -47.84 83.86 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.334 -0.853 . . . . 1.33 111.084 -179.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.71 -49.67 75.53 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.114 -0.991 . . . . 0.46 110.651 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.453 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -66.21 -40.14 90.13 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.691 -0.63 . . . . 0.39 110.879 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.454 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.19 -38.37 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 108.516 -0.92 . . . . 0.57 108.516 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 30' ' ' ASP . 64.0 mmtt -60.49 -40.0 89.74 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.527 -0.733 . . . . 2.82 109.197 177.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -61.23 -53.07 61.51 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.704 -0.623 . . . . 1.73 109.666 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.606 HD22 ' HA2' ' A' ' 13' ' ' GLY . 0.1 OUTLIER -60.16 -40.09 88.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.657 -0.652 . . . . 1.53 109.644 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.06 -39.97 87.84 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.391 -0.818 . . . . 1.36 109.583 179.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -59.99 -39.47 85.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 1.31 109.391 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HG12 ' A' ' 9' ' ' VAL . 93.6 mt -59.96 -55.21 36.86 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.618 -0.676 . . . . 0.72 110.581 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.7 pttp -65.77 -29.96 70.54 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.175 -0.953 . . . . 2.38 109.428 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.59 92.52 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.295 -0.562 . . . . 0.69 109.645 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -63.83 -44.64 92.63 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.233 -1.025 . . . . 1.9 108.233 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -60.42 -41.65 94.4 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.623 0.725 . . . . 2.03 109.836 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.98 -39.75 86.79 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.829 -0.545 . . . . 2.12 111.237 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -55.68 -40.01 71.73 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.347 -0.846 . . . . 2.41 111.187 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -63.71 -85.01 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.234 -0.916 . . . . 2.31 110.623 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.4 t -159.97 51.75 0.33 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.014 -1.054 . . . . 2.51 111.705 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.28 41.22 69.11 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.616 -0.994 . . . . 1.86 110.616 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -95.56 23.18 6.27 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.47 -1.017 . . . . 2.7 111.048 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.9 141.18 55.94 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.592 0.711 . . . . 2.37 110.236 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.49 ' CD2' HG21 ' A' ' 9' ' ' VAL . 55.6 p90 . . . . . 0 N--CA 1.499 1.986 0 CA-C-O 121.502 0.668 . . . . 2.77 111.452 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 120.94 0.4 . . . . 1.69 110.556 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.461 HG13 ' N ' ' A' ' 5' ' ' LEU . 7.8 p -55.27 -43.48 71.15 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.417 -0.802 . . . . 1.52 110.48 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.461 ' N ' HG13 ' A' ' 4' ' ' VAL . 81.1 mt -60.2 -40.0 88.56 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.637 -0.664 . . . . 1.92 109.428 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.415 ' O ' HG22 ' A' ' 9' ' ' VAL . 0.3 OUTLIER -57.03 -47.58 80.57 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-O 121.488 0.661 . . . . 3.87 109.599 179.346 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.572 ' O ' HG13 ' A' ' 11' ' ' VAL . 78.3 m-20 -62.43 -40.07 95.36 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.622 -0.674 . . . . 1.35 110.799 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.74 ' HG2' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -59.97 -49.89 75.88 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.408 -0.808 . . . . 2.93 110.647 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.79 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.03 -40.0 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 1.07 109.23 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -59.97 -49.74 76.48 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.79 0.663 . . . . 0.42 112.79 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.825 ' O ' HG23 ' A' ' 15' ' ' VAL . 34.2 m -59.88 -45.38 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.172 -0.955 . . . . 0.95 111.037 -177.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.486 ' HG3' HD11 ' A' ' 39' ' ' LEU . 93.7 mm-40 -60.93 -49.46 77.37 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.106 -0.996 . . . . 1.84 109.673 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.53 -58.85 2.04 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.408 -1.077 . . . . 0.36 110.408 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -63.64 -36.29 83.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.835 -0.803 . . . . 1.12 111.028 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.825 HG23 ' O ' ' A' ' 11' ' ' VAL . 90.1 t -60.01 -40.48 83.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.332 -0.855 . . . . 0.46 109.579 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 32' ' ' ALA . 66.5 t -60.2 -50.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.394 -0.816 . . . . 0.7 109.235 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -62.56 -42.95 99.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.65 -0.657 . . . . 3.15 111.244 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.96 -44.44 94.43 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.557 -0.714 . . . . 2.23 110.722 -178.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.4 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.822 -0.549 . . . . 1.02 110.904 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.667 ' HD3' HG21 ' A' ' 29' ' ' VAL . 12.2 tptt -65.99 -40.05 90.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.646 -0.659 . . . . 2.08 109.383 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.58 -26.99 67.36 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.841 -0.8 . . . . 0.81 108.841 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 98.3 mttt -86.17 9.13 18.39 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.058 -0.657 . . . . 2.11 110.509 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 84.6 mttt 58.97 19.94 7.68 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.377 -0.827 . . . . 2.28 110.968 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.596 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -58.94 167.58 1.88 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.57 -0.706 . . . . 0.71 109.734 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.489 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 51.4 Cg_endo -73.61 163.99 36.03 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 O-C-N 123.355 1.187 . . . . 0.93 110.107 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mttp -54.59 -23.55 17.38 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.473 -0.767 . . . . 2.0 109.594 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -56.71 -40.57 75.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.704 -0.623 . . . . 2.22 110.383 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.596 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 86.6 m-20 -73.22 -42.27 62.82 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.545 -0.722 . . . . 1.46 111.023 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.667 HG21 ' HD3' ' A' ' 20' ' ' LYS . 62.5 t -69.94 -54.04 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.538 -0.726 . . . . 0.65 110.963 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -60.21 -41.02 92.13 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.43 -0.794 . . . . 1.33 112.101 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.95 75.41 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.241 -0.912 . . . . 0.46 110.9 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.569 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -66.43 -41.41 89.23 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 119.938 -0.705 . . . . 0.39 110.192 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.403 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -66.63 -39.03 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.044 -1.095 . . . . 0.57 108.044 178.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -60.26 -43.74 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.179 -1.045 . . . . 2.82 108.179 177.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -65.81 -45.81 80.96 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.562 -0.903 . . . . 1.73 108.562 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.403 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 7.9 tp -59.69 -39.95 86.28 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 109.749 -0.463 . . . . 1.53 109.749 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -58.9 -39.99 83.13 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.369 -0.832 . . . . 1.36 109.512 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -61.53 -41.53 97.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 1.31 109.137 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.79 ' HB3' HG12 ' A' ' 9' ' ' VAL . 71.6 mt -62.57 -49.93 73.33 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.818 -0.808 . . . . 0.72 108.818 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -60.06 -40.02 88.03 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.56 0.695 . . . . 2.38 109.231 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.7 -44.27 96.78 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.951 -0.468 . . . . 0.69 110.649 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.01 -47.17 86.95 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.248 -0.907 . . . . 1.9 109.594 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -42.74 94.79 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.918 0.866 . . . . 2.03 109.466 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -60.62 -40.03 90.4 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.942 -0.572 . . . . 2.12 112.137 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.44 -39.95 85.22 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.288 -0.882 . . . . 2.41 111.595 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -61.53 -51.26 69.32 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.291 -0.881 . . . . 2.31 111.462 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 47' ' ' THR . 82.4 m -157.91 16.13 0.23 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.27 -0.894 . . . . 2.51 112.093 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.03 37.74 73.67 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.074 -1.21 . . . . 1.86 110.074 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.47 ' O ' ' O ' ' A' ' 50' ' ' GLU . 97.9 mt-30 -84.73 -24.06 29.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.487 -1.008 . . . . 2.7 110.714 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 49' ' ' GLN . 13.3 pt-20 40.91 175.18 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.628 0 CA-C-O 122.57 1.176 . . . . 2.37 113.924 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.425 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.6 t80 . . . . . 0 N--CA 1.5 2.054 0 O-C-N 121.149 -0.969 . . . . 2.77 110.982 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 120.691 0.281 . . . . 1.69 110.736 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.468 HG23 ' N ' ' A' ' 5' ' ' LEU . 35.7 m -55.62 -42.07 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.349 -0.845 . . . . 1.52 110.385 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.468 ' N ' HG23 ' A' ' 4' ' ' VAL . 68.6 mt -60.47 -41.43 94.18 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.499 -0.751 . . . . 1.92 109.603 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -42.8 78.51 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.8 -0.563 . . . . 3.87 110.129 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.612 ' O ' HG23 ' A' ' 11' ' ' VAL . 28.9 m120 -59.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.574 -0.704 . . . . 1.35 111.509 -179.274 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -60.08 -56.32 23.05 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.178 -0.951 . . . . 2.93 110.378 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.607 HG21 ' CD1' ' A' ' 51' ' ' TYR . 8.6 p -69.32 -38.03 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.401 -0.812 . . . . 1.07 110.128 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -46.43 89.49 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.57 -0.706 . . . . 0.42 111.557 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 7' ' ' ASN . 63.6 t -59.98 -47.96 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.548 -0.72 . . . . 0.95 110.383 -178.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.487 ' O ' HG12 ' A' ' 15' ' ' VAL . 6.7 tp-100 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.359 -0.838 . . . . 1.84 109.97 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -42.6 -48.53 5.93 Favored Glycine 0 N--CA 1.508 3.48 0 N-CA-C 110.181 -1.168 . . . . 0.36 110.181 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -62.89 -37.36 86.63 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.999 -0.707 . . . . 1.12 111.464 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.487 HG12 ' O ' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -59.21 -39.24 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.156 -0.965 . . . . 0.46 109.702 -179.023 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.48 HG22 ' CB ' ' A' ' 32' ' ' ALA . 54.5 t -59.97 -44.8 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 N-CA-C 108.924 -0.769 . . . . 0.7 108.924 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -59.99 -41.6 92.38 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 3.15 109.868 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.04 -40.1 95.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 2.23 111.18 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.08 -40.0 92.06 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.411 -0.806 . . . . 1.02 110.86 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.504 ' CD ' HG21 ' A' ' 29' ' ' VAL . 12.4 tptm -65.69 -42.31 91.35 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.504 -0.747 . . . . 2.08 109.028 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.82 64.38 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.767 -0.827 . . . . 0.81 108.767 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp -85.95 8.62 19.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.683 -0.636 . . . . 2.11 110.721 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 59.3 20.09 8.27 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.272 -0.892 . . . . 2.28 111.144 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.99 161.76 8.38 Favored Pre-proline 0 N--CA 1.498 1.945 0 O-C-N 121.506 -0.746 . . . . 0.71 110.137 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.39 165.26 32.26 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.485 1.255 . . . . 0.93 110.912 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -57.0 -31.7 65.36 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.672 -0.642 . . . . 2.0 110.673 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.64 -40.02 82.23 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.571 -0.705 . . . . 2.22 110.507 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -70.13 -41.45 73.89 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.637 -0.664 . . . . 1.46 110.77 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.504 HG21 ' CD ' ' A' ' 20' ' ' LYS . 99.8 t -66.93 -51.27 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.566 -0.709 . . . . 0.65 109.751 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.3 m-20 -60.02 -45.6 92.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.758 -0.589 . . . . 1.33 110.758 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.46 75.39 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.311 -0.868 . . . . 0.46 110.36 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.48 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -63.34 -43.5 97.56 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.139 -0.624 . . . . 0.39 110.628 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.656 ' HA ' HD23 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -65.63 -37.34 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 119.456 -0.898 . . . . 0.57 108.839 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 tppt? -59.97 -39.2 84.83 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.778 0.799 . . . . 2.82 109.207 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -60.0 -45.67 91.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.924 -0.485 . . . . 1.73 110.703 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.656 HD23 ' HA ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -60.06 -35.29 74.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.298 -0.876 . . . . 1.53 110.344 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.515 HD12 ' HG ' ' A' ' 36' ' ' LEU . 2.2 mp -58.66 -39.77 81.59 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.234 -0.916 . . . . 1.36 109.643 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.451 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 24.6 p -60.01 -40.01 87.81 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 109.095 -0.705 . . . . 1.31 109.095 179.075 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.5 mt -65.16 -47.66 76.27 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.986 -0.746 . . . . 0.72 108.986 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -61.39 -31.57 71.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.148 -0.686 . . . . 2.38 109.148 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 38' ' ' SER . . . -59.84 -41.5 91.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.698 -0.626 . . . . 0.69 109.419 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.87 -48.64 79.6 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 119.79 -0.764 . . . . 1.9 109.208 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.458 ' CE2' ' CB ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -61.06 -38.51 86.46 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.917 0.865 . . . . 2.03 108.772 178.076 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -60.55 -27.31 67.56 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 116.085 -0.507 . . . . 2.12 111.308 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -55.02 -39.85 69.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.252 -0.905 . . . . 2.41 110.929 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -64.63 -59.85 3.8 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.549 -0.861 . . . . 2.31 110.356 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -165.55 28.89 0.05 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.296 -0.878 . . . . 2.51 111.637 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.98 73.38 0.69 Allowed Glycine 0 N--CA 1.497 2.765 0 N-CA-C 108.994 -1.643 . . . . 1.86 108.994 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 28.9 mm100 -87.02 -16.42 35.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.634 -0.921 . . . . 2.7 111.984 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 30.26 100.22 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 113.267 0.84 . . . . 2.37 113.267 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.607 ' CD1' HG21 ' A' ' 9' ' ' VAL . 32.6 p90 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.125 -0.984 . . . . 2.77 111.492 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp . . . . . 0 N--CA 1.498 1.962 0 CA-C-O 121.525 0.678 . . . . 1.69 109.363 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.5 t -55.42 -44.07 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 N-CA-C 109.348 -0.612 . . . . 1.52 109.348 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.39 -40.5 94.56 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.782 -0.574 . . . . 1.92 110.662 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.458 ' O ' HG22 ' A' ' 9' ' ' VAL . 11.1 m-85 -59.75 -40.05 86.82 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.498 -0.751 . . . . 3.87 110.463 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.868 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 m120 -60.16 -40.21 89.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.574 -0.704 . . . . 1.35 110.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.92 -49.76 76.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.485 -0.759 . . . . 2.93 111.232 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.525 ' HA ' HD13 ' A' ' 39' ' ' LEU . 26.9 m -65.21 -39.95 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 1.07 109.61 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.57 -38.34 84.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.465 -0.772 . . . . 0.42 110.736 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.868 HG23 ' O ' ' A' ' 7' ' ' ASN . 72.7 t -60.1 -50.13 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.642 -0.661 . . . . 0.95 110.7 -177.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.465 ' HG2' HD11 ' A' ' 39' ' ' LEU . 6.7 mp0 -61.87 -50.93 70.25 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.011 -1.056 . . . . 1.84 109.818 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.58 -49.93 4.84 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.974 -1.25 . . . . 0.36 109.974 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.39 -36.8 85.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 122.07 -0.665 . . . . 1.12 111.342 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 68.3 t -59.66 -41.07 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.188 -0.945 . . . . 0.46 109.726 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -59.94 -48.09 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.265 -0.897 . . . . 0.7 108.944 178.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -60.05 -47.6 85.17 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.656 -0.652 . . . . 3.15 110.337 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -62.47 -42.55 99.56 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.589 -0.694 . . . . 2.23 111.192 -178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.7 -40.25 96.32 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.317 -0.865 . . . . 1.02 111.039 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.502 ' HD2' HG21 ' A' ' 29' ' ' VAL . 17.0 tptm -66.33 -40.23 89.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.637 -0.665 . . . . 2.08 109.882 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -28.12 68.12 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.474 -0.936 . . . . 0.81 108.474 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 62.7 mtpt -84.08 8.77 14.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.854 -0.529 . . . . 2.11 111.002 178.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 95.3 mttt 57.61 27.57 14.4 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 2.28 111.094 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.419 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -57.18 163.43 3.19 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.739 -0.601 . . . . 0.71 110.706 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.419 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 43.7 Cg_endo -68.9 166.17 27.37 Favored 'Trans proline' 0 C--N 1.315 -1.217 0 O-C-N 123.592 1.312 . . . . 0.93 110.081 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -58.52 -34.33 70.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.671 -0.643 . . . . 2.0 110.811 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.65 -39.79 74.31 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.583 -0.698 . . . . 2.22 110.419 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.86 -46.57 57.47 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.658 -0.651 . . . . 1.46 111.326 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.502 HG21 ' HD2' ' A' ' 20' ' ' LYS . 94.3 t -69.41 -50.05 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.251 -0.906 . . . . 0.65 111.134 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.446 ' O ' HG12 ' A' ' 33' ' ' VAL . 59.3 m-20 -59.91 -49.11 78.98 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.454 -0.779 . . . . 1.33 111.277 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.0 -46.21 91.68 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.506 -0.747 . . . . 0.46 110.766 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.31 80.5 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 119.867 -0.733 . . . . 0.39 110.159 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -64.97 -39.63 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.19 -1.041 . . . . 0.57 108.19 179.407 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.441 ' HA ' HD12 ' A' ' 37' ' ' LEU . 34.7 tttp -61.52 -41.64 97.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.105 -1.072 . . . . 2.82 108.105 177.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -65.84 -42.84 90.0 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.539 -0.912 . . . . 1.73 108.539 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.602 HD13 ' C ' ' A' ' 36' ' ' LEU . 3.3 tm? -60.04 -40.81 90.66 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 115.952 -0.567 . . . . 1.53 109.719 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 34' ' ' LYS . 74.4 mt -59.99 -39.71 86.66 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.611 -0.68 . . . . 1.36 109.754 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.6 t -59.87 -36.62 77.27 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 1.31 109.521 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 9' ' ' VAL . 82.3 mt -60.05 -51.09 71.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.611 -0.681 . . . . 0.72 110.117 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -60.98 -39.33 89.22 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.527 -0.733 . . . . 2.38 109.627 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.55 91.87 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.766 -0.584 . . . . 0.69 110.487 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -60.79 -49.45 77.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.306 -0.871 . . . . 1.9 109.591 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -61.37 -38.26 86.36 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.688 -0.632 . . . . 2.03 110.092 178.749 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -59.89 -37.78 80.36 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.72 -0.613 . . . . 2.12 110.771 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -57.98 -39.46 78.23 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.423 -0.798 . . . . 2.41 111.25 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -61.21 -54.33 45.57 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.12 -0.988 . . . . 2.31 111.229 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.573 ' O ' HG22 ' A' ' 47' ' ' THR . 41.4 m -156.61 16.47 0.31 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.256 -0.902 . . . . 2.51 111.433 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.74 29.97 68.89 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.48 -1.048 . . . . 1.86 110.48 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' GLU . 91.5 mm-40 -83.95 -23.83 30.94 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.32 -1.106 . . . . 2.7 110.866 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.432 ' HA ' ' HB3' ' A' ' 43' ' ' TYR . 8.5 pt-20 40.64 -175.1 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 121.805 0.812 . . . . 2.37 112.855 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.1 t80 . . . . . 0 N--CA 1.5 2.059 0 O-C-N 121.152 -0.968 . . . . 2.77 110.595 -178.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 N--CA 1.499 2.021 0 CA-C-O 121.464 0.649 . . . . 1.69 110.436 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -60.01 -48.94 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 1.52 110.608 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -45.02 94.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.297 -0.877 . . . . 1.92 110.604 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.418 ' O ' HG22 ' A' ' 9' ' ' VAL . 33.6 t80 -59.95 -43.5 94.97 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.419 -0.801 . . . . 3.87 110.361 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.645 ' O ' HG13 ' A' ' 11' ' ' VAL . 96.2 m-20 -60.01 -40.26 88.65 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.516 -0.74 . . . . 1.35 110.736 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.609 ' HG3' HD13 ' A' ' 39' ' ' LEU . 8.8 tpt180 -60.01 -50.02 75.37 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.522 -0.736 . . . . 2.93 110.611 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.799 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.72 -40.05 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.12 -0.987 . . . . 1.07 109.253 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.99 74.17 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 112.832 0.679 . . . . 0.42 112.832 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 7' ' ' ASN . 33.4 m -60.08 -49.01 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.229 -0.92 . . . . 0.95 111.968 -177.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.598 ' CD ' HD11 ' A' ' 39' ' ' LEU . 75.6 mt-30 -62.94 -42.61 99.86 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.872 -1.143 . . . . 1.84 109.492 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.842 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -43.63 -52.6 6.39 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.695 -1.362 . . . . 0.36 109.695 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -62.68 -34.76 77.76 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.926 -0.749 . . . . 1.12 111.221 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 11' ' ' VAL . 92.0 t -59.62 -40.04 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.29 -0.881 . . . . 0.46 109.584 -179.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.616 HG22 HG23 ' A' ' 33' ' ' VAL . 55.6 t -59.99 -49.97 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 N-CA-C 108.592 -0.892 . . . . 0.7 108.592 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -64.85 -40.93 95.95 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.37 0.605 . . . . 3.15 110.536 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.0 -48.62 80.96 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.73 -0.606 . . . . 2.23 110.775 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 28' ' ' ASP . 87.1 mt -59.99 -40.51 89.44 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.643 -0.661 . . . . 1.02 110.41 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.829 ' HD3' HG21 ' A' ' 29' ' ' VAL . 35.0 tptt -69.92 -39.67 76.0 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.618 -0.882 . . . . 2.08 108.618 179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.01 -31.72 70.2 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.0 -0.741 . . . . 0.81 109.0 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.548 ' HD3' HD23 ' A' ' 19' ' ' LEU . 15.9 ptmt -92.23 19.4 7.03 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 119.529 -0.869 . . . . 2.11 110.488 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.7 mttm 59.6 20.26 8.83 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.451 -0.78 . . . . 2.28 111.678 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.4 158.7 13.82 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.413 -0.805 . . . . 0.71 109.712 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -73.25 167.23 27.85 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.322 1.169 . . . . 0.93 110.153 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -54.96 -24.56 24.52 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.522 -0.736 . . . . 2.0 109.566 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -57.02 -41.86 79.33 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.728 -0.608 . . . . 2.22 110.209 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.585 ' HB3' HD22 ' A' ' 19' ' ' LEU . 69.2 m-20 -75.44 -48.44 22.76 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.685 -0.634 . . . . 1.46 111.32 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.829 HG21 ' HD3' ' A' ' 20' ' ' LYS . 79.5 t -63.35 -49.54 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 0.65 109.786 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.95 -40.21 88.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.58 -0.7 . . . . 1.33 110.883 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.78 -51.64 68.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.301 -0.874 . . . . 0.46 110.538 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.14 90.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.629 -0.67 . . . . 0.39 109.296 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.616 HG23 HG22 ' A' ' 16' ' ' VAL . 9.1 t -64.59 -45.67 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 108.455 -0.943 . . . . 0.57 108.455 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -60.01 -40.95 91.02 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.261 -0.899 . . . . 2.82 108.822 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -65.11 -49.4 70.11 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.466 -0.939 . . . . 1.73 108.466 178.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.842 HD22 ' HA2' ' A' ' 13' ' ' GLY . 6.7 tp -60.0 -39.54 86.12 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 115.821 -0.627 . . . . 1.53 109.689 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.0 mt -58.22 -38.66 77.26 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.419 -0.8 . . . . 1.36 109.608 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.1 t -60.5 -40.7 92.32 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.607 -0.683 . . . . 1.31 109.475 178.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.799 ' HB3' HG12 ' A' ' 9' ' ' VAL . 46.4 mt -66.8 -50.95 60.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 109.008 -0.738 . . . . 0.72 109.008 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -59.99 -39.89 87.32 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.524 0.678 . . . . 2.38 109.274 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.81 80.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.907 -0.496 . . . . 0.69 110.512 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -60.04 -49.95 75.64 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.289 -0.882 . . . . 1.9 110.236 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.37 -39.96 92.55 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.573 -0.705 . . . . 2.03 110.001 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -60.0 -39.35 85.47 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.758 -0.589 . . . . 2.12 110.484 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -58.79 -37.63 76.77 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.549 -0.72 . . . . 2.41 111.12 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -61.26 -54.48 43.49 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.195 -0.941 . . . . 2.31 111.055 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.16 18.21 0.36 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.113 -0.992 . . . . 2.51 111.659 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.97 33.58 70.28 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 110.466 -1.053 . . . . 1.86 110.466 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -86.72 -13.0 46.62 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.33 -1.1 . . . . 2.7 111.628 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 35.92 -156.03 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 N-CA-C 112.807 0.669 . . . . 2.37 112.807 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.6 t80 . . . . . 0 N--CA 1.497 1.905 0 O-C-N 121.17 -0.956 . . . . 2.77 110.552 -179.569 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.4 ' C ' HD23 ' A' ' 3' ' ' LEU . 7.9 tt . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 120.797 0.332 . . . . 1.69 110.729 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.479 HG13 HD22 ' A' ' 5' ' ' LEU . 2.9 p -56.23 -40.88 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 O-C-N 121.272 -0.892 . . . . 1.52 110.461 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.479 HD22 HG13 ' A' ' 4' ' ' VAL . 3.5 mm? -59.79 -40.63 88.99 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.558 -0.714 . . . . 1.92 109.633 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.428 ' O ' HG22 ' A' ' 9' ' ' VAL . 10.3 m-85 -59.94 -40.12 87.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.611 -0.681 . . . . 3.87 110.016 178.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.832 ' O ' HG23 ' A' ' 11' ' ' VAL . 97.6 m-20 -61.47 -41.47 97.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.618 -0.676 . . . . 1.35 110.704 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttt85 -59.95 -49.73 76.55 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.541 -0.725 . . . . 2.93 111.101 -178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.911 ' HA ' HD13 ' A' ' 39' ' ' LEU . 33.1 m -66.72 -39.83 84.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.437 -0.789 . . . . 1.07 108.93 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.84 -38.57 85.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.797 -0.565 . . . . 0.42 110.97 178.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 7' ' ' ASN . 60.1 t -60.02 -49.95 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.455 -0.778 . . . . 0.95 109.985 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.843 ' HG3' HD11 ' A' ' 39' ' ' LEU . 99.6 mm-40 -60.22 -51.91 67.54 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.078 -1.014 . . . . 1.84 109.283 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.01 -58.26 2.34 Favored Glycine 0 N--CA 1.506 3.331 0 N-CA-C 110.68 -0.968 . . . . 0.36 110.68 -178.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.66 -38.52 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.912 -0.758 . . . . 1.12 111.088 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 11' ' ' VAL . 85.2 t -59.75 -39.96 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.313 -0.867 . . . . 0.46 109.683 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.552 HG22 ' CB ' ' A' ' 32' ' ' ALA . 60.1 t -60.04 -49.76 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 N-CA-C 108.864 -0.791 . . . . 0.7 108.864 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -59.98 -43.48 95.1 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.72 -0.612 . . . . 3.15 110.103 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.58 -41.55 97.57 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 2.23 111.341 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.35 -42.92 96.76 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.24 -0.913 . . . . 1.02 109.9 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.57 ' CD ' HG21 ' A' ' 29' ' ' VAL . 20.0 tptp -65.75 -40.0 91.67 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.794 -0.817 . . . . 2.08 108.794 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -26.69 66.72 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.725 -0.842 . . . . 0.81 108.725 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -86.97 10.28 16.85 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.113 -0.635 . . . . 2.11 110.793 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 94.4 mttt 57.35 21.38 6.74 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.294 -0.879 . . . . 2.28 111.091 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.418 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -60.87 162.47 12.22 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.615 -0.678 . . . . 0.71 109.406 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.46 162.69 39.64 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.211 1.111 . . . . 0.93 111.047 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -54.48 -24.45 20.42 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.735 -0.603 . . . . 2.0 110.197 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -59.53 -40.94 88.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.643 -0.661 . . . . 2.22 110.059 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.418 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 70.0 m-20 -72.61 -45.61 58.24 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.482 -0.761 . . . . 1.46 110.843 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.57 HG21 ' CD ' ' A' ' 20' ' ' LYS . 87.1 t -67.02 -50.77 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.553 -0.717 . . . . 0.65 110.305 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' HG12 ' A' ' 33' ' ' VAL . 86.3 m-20 -60.13 -43.62 95.54 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.573 -0.705 . . . . 1.33 111.121 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.01 73.47 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.381 -0.824 . . . . 0.46 110.655 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.552 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -65.38 -42.53 92.59 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 120.261 -0.576 . . . . 0.39 110.492 -179.372 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.67 -36.57 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.084 -1.08 . . . . 0.57 108.084 179.214 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -60.06 -44.13 94.93 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.98 -1.118 . . . . 2.82 107.98 177.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -62.44 -40.03 95.29 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.85 0.833 . . . . 1.73 108.852 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.882 HD22 HD12 ' A' ' 39' ' ' LEU . 2.8 tm? -59.71 -41.5 90.96 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.4 -0.593 . . . . 1.53 109.4 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.4 mt -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.575 -0.703 . . . . 1.36 110.39 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 p -62.12 -27.92 69.27 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.355 -0.841 . . . . 1.31 109.495 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.911 HD13 ' HA ' ' A' ' 9' ' ' VAL . 83.1 mt -66.9 -58.57 4.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.265 -0.897 . . . . 0.72 109.131 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.412 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 1.3 ptpm? -61.77 -35.53 78.41 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.762 0.791 . . . . 2.38 109.072 178.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.412 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -59.98 -50.05 75.26 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 116.106 -0.497 . . . . 0.69 109.948 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.34 -40.06 93.16 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.508 -0.745 . . . . 1.9 109.759 179.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.46 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -58.98 -39.59 82.22 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.682 -0.636 . . . . 2.03 109.989 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -59.94 -40.04 87.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.604 -0.685 . . . . 2.12 111.046 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.9 -39.25 80.92 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.397 -0.814 . . . . 2.41 111.238 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.673 ' O ' HG23 ' A' ' 47' ' ' THR . 58.4 mttm -64.94 -59.95 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.28 -0.968 . . . . 2.31 110.767 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.673 HG23 ' O ' ' A' ' 46' ' ' LYS . 1.0 OUTLIER -159.46 12.52 0.14 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.254 -0.904 . . . . 2.51 112.741 -179.771 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.84 55.23 20.75 Favored Glycine 0 N--CA 1.498 2.821 0 N-CA-C 109.169 -1.573 . . . . 1.86 109.169 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.46 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 97.1 mt-30 -83.22 -20.49 34.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.579 -0.954 . . . . 2.7 111.61 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 30.28 85.8 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.986 0 N-CA-C 112.892 0.701 . . . . 2.37 112.892 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.1 p90 . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.449 -0.782 . . . . 2.77 111.252 -178.797 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 121.616 0.722 . . . . 1.69 110.114 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 90.5 t -59.22 -40.11 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.836 -0.54 . . . . 1.52 110.425 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.04 -48.8 80.2 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.417 -0.802 . . . . 1.92 110.565 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.416 ' O ' HG22 ' A' ' 9' ' ' VAL . 13.3 m-85 -59.88 -39.76 86.38 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.519 -0.738 . . . . 3.87 110.796 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.799 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.5 m-20 -59.91 -39.46 85.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.419 -0.801 . . . . 1.35 110.171 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.1 mmt-85 -59.93 -50.72 72.66 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.502 -0.749 . . . . 2.93 110.342 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.873 ' HA ' HD13 ' A' ' 39' ' ' LEU . 35.5 m -67.79 -40.04 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 C-N-CA 119.48 -0.888 . . . . 1.07 109.348 178.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.96 -36.79 77.86 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.571 -0.706 . . . . 0.42 110.278 178.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 7' ' ' ASN . 40.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.486 -0.759 . . . . 0.95 111.305 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.524 ' CD ' HD11 ' A' ' 39' ' ' LEU . 2.8 mp0 -60.0 -52.62 64.62 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.045 -1.034 . . . . 1.84 110.055 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.551 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -42.11 -54.85 4.4 Favored Glycine 0 N--CA 1.508 3.485 0 N-CA-C 110.178 -1.169 . . . . 0.36 110.178 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -65.61 -38.3 89.05 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.837 -0.802 . . . . 1.12 111.72 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 11' ' ' VAL . 54.5 t -59.68 -40.01 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.219 -0.925 . . . . 0.46 109.233 -178.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.3 t -60.0 -49.99 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.398 -0.814 . . . . 0.7 109.368 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -60.0 -43.36 95.23 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.441 -0.787 . . . . 3.15 109.761 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -60.34 -47.61 85.28 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.756 -0.59 . . . . 2.23 110.772 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.96 -44.04 94.67 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.61 -0.682 . . . . 1.02 110.591 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.677 ' HD3' HG21 ' A' ' 29' ' ' VAL . 38.3 tptt -65.69 -40.3 92.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.521 -0.737 . . . . 2.08 109.146 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.78 -26.54 68.68 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.499 -0.926 . . . . 0.81 108.499 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 45.6 mtpt -87.74 12.01 13.9 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.754 -0.591 . . . . 2.11 110.644 179.234 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.8 mtmt 59.8 20.8 9.64 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.383 -0.823 . . . . 2.28 111.195 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.87 161.78 6.18 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.461 -0.774 . . . . 0.71 109.663 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.22 162.1 43.55 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.379 1.2 . . . . 0.93 110.333 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -55.64 -27.35 49.28 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.589 -0.694 . . . . 2.0 110.028 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -59.97 -39.95 87.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.73 -0.607 . . . . 2.22 110.294 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -70.53 -43.12 70.24 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.205 -0.934 . . . . 1.46 110.676 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.677 HG21 ' HD3' ' A' ' 20' ' ' LYS . 61.4 t -69.36 -51.96 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.485 -0.759 . . . . 0.65 110.047 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' HG12 ' A' ' 33' ' ' VAL . 61.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 1.33 110.879 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.81 -47.48 83.26 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.382 -0.824 . . . . 0.46 110.399 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.95 84.62 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.09 -0.644 . . . . 0.39 110.279 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -64.66 -35.93 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.304 -0.998 . . . . 0.57 108.304 179.344 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -60.08 -42.86 95.49 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.318 -0.993 . . . . 2.82 108.318 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -60.58 -40.0 90.1 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.326 -0.99 . . . . 1.73 108.326 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.696 HD23 HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -54.85 -44.29 73.84 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.804 -0.634 . . . . 1.53 110.54 179.565 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.444 -0.785 . . . . 1.36 109.699 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.0 t -59.87 -32.68 70.94 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.297 -0.631 . . . . 1.31 109.297 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.873 HD13 ' HA ' ' A' ' 9' ' ' VAL . 78.8 mt -65.52 -57.97 6.92 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 120.077 -0.649 . . . . 0.72 109.416 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.02 -33.44 72.0 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.421 -0.799 . . . . 2.38 109.607 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.48 -42.24 91.61 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.267 -0.573 . . . . 0.69 109.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.02 -48.14 82.95 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 107.98 -1.119 . . . . 1.9 107.98 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -60.29 -39.05 85.54 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.723 0.773 . . . . 2.03 109.417 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -60.01 -33.08 71.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.831 -0.543 . . . . 2.12 111.065 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.46 -39.97 71.03 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.463 -0.773 . . . . 2.41 110.14 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.83 -74.93 0.1 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.506 -0.746 . . . . 2.31 109.868 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.3 t -160.05 30.17 0.18 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.473 -0.767 . . . . 2.51 110.241 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.18 68.4 1.65 Allowed Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.517 -1.433 . . . . 1.86 109.517 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -88.41 -26.85 21.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.586 -0.949 . . . . 2.7 111.428 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 11.2 pt-20 31.23 97.56 0.0 OUTLIER 'General case' 0 N--CA 1.519 3.003 0 N-CA-C 112.772 0.656 . . . . 2.37 112.772 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.46 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 46.7 p90 . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.103 -0.998 . . . . 2.77 111.52 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 121.68 0.752 . . . . 1.69 109.467 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.18 -44.47 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.984 -0.448 . . . . 1.52 109.945 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.02 -44.93 94.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.431 -0.793 . . . . 1.92 109.496 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -60.06 -41.65 92.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.743 -0.598 . . . . 3.87 111.27 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.691 ' O ' HG23 ' A' ' 11' ' ' VAL . 26.9 m120 -60.04 -40.63 90.07 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.472 -0.768 . . . . 1.35 111.213 -178.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.4 mtp180 -60.03 -50.37 73.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.383 -0.823 . . . . 2.93 110.503 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.782 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.67 -40.03 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.754 -0.832 . . . . 1.07 108.754 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -38.46 82.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.708 -0.62 . . . . 0.42 110.554 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.691 HG23 ' O ' ' A' ' 7' ' ' ASN . 30.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.553 -0.717 . . . . 0.95 110.46 -179.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -60.67 -53.58 55.76 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.259 -0.9 . . . . 1.84 109.738 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.735 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -39.32 -55.5 2.48 Favored Glycine 0 N--CA 1.51 3.567 0 N-CA-C 110.632 -0.987 . . . . 0.36 110.632 -178.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -61.95 -38.52 88.8 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.92 -0.753 . . . . 1.12 111.388 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' ' 11' ' ' VAL . 99.4 t -59.94 -41.96 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.319 -0.863 . . . . 0.46 109.51 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.9 t -60.7 -47.65 92.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 0.7 109.378 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -59.99 -41.14 91.42 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.56 -0.713 . . . . 3.15 110.502 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.95 -40.99 97.69 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.515 -0.74 . . . . 2.23 111.201 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.99 -43.88 94.88 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.347 -0.845 . . . . 1.02 110.656 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.746 ' CD ' HG21 ' A' ' 29' ' ' VAL . 17.2 tptt -65.15 -39.98 93.72 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.713 -0.847 . . . . 2.08 108.713 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.95 -24.19 66.84 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.71 -0.848 . . . . 0.81 108.71 177.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -88.13 10.52 19.04 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 2.11 110.423 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt 60.08 19.92 9.14 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.375 -0.828 . . . . 2.28 111.396 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.92 163.42 9.84 Favored Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.562 -0.711 . . . . 0.71 109.968 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.2 160.49 45.16 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.321 1.169 . . . . 0.93 110.392 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -56.91 -29.49 63.08 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.623 -0.673 . . . . 2.0 111.002 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.93 -40.01 75.57 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.36 -0.838 . . . . 2.22 110.688 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -70.51 -43.37 69.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.417 -0.802 . . . . 1.46 110.576 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.746 HG21 ' CD ' ' A' ' 20' ' ' LYS . 77.7 t -68.41 -47.8 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.637 -0.664 . . . . 0.65 110.648 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -59.97 -44.05 94.68 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.391 -0.818 . . . . 1.33 110.349 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.4 76.2 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.556 -0.715 . . . . 0.46 110.138 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.05 -43.2 96.23 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.647 . . . . 0.39 110.624 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -35.29 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 108.492 -0.929 . . . . 0.57 108.492 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -60.02 -40.04 87.95 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.442 -1.318 . . . . 2.82 107.442 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -60.25 -39.96 88.62 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.209 -1.034 . . . . 1.73 108.209 177.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.735 HD11 ' HA2' ' A' ' 13' ' ' GLY . 0.6 OUTLIER -56.98 -45.03 83.24 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 116.033 -0.53 . . . . 1.53 110.173 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -38.34 72.84 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.528 -0.732 . . . . 1.36 109.871 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -61.38 -40.03 92.85 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 109.151 -0.685 . . . . 1.31 109.151 178.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.782 ' HB3' HG12 ' A' ' 9' ' ' VAL . 55.7 mt -65.99 -55.16 18.15 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.619 -0.882 . . . . 0.72 108.619 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -60.0 -36.49 77.31 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.363 0.602 . . . . 2.38 109.651 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.72 94.79 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.822 -0.549 . . . . 0.69 110.213 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.97 -48.0 83.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.269 -0.894 . . . . 1.9 109.142 178.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.6 -39.96 90.07 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.623 0.725 . . . . 2.03 109.217 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.424 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 88.6 tttt -60.05 -38.33 82.5 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.707 -0.62 . . . . 2.12 110.958 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.29 -39.96 80.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.546 -0.721 . . . . 2.41 112.11 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 mttt -61.08 -53.51 56.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.031 -1.043 . . . . 2.31 110.654 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.498 ' O ' HG22 ' A' ' 47' ' ' THR . 22.3 m -156.76 13.91 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.487 -0.758 . . . . 2.51 112.021 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.424 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 70.02 39.41 74.0 Favored Glycine 0 N--CA 1.498 2.814 0 N-CA-C 110.201 -1.16 . . . . 1.86 110.201 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 50' ' ' GLU . 45.4 mt-30 -85.59 -20.13 29.99 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.365 -1.079 . . . . 2.7 111.483 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.535 ' O ' ' O ' ' A' ' 49' ' ' GLN . 15.5 pt-20 42.09 161.92 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.704 1.24 . . . . 2.37 113.853 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.9 t80 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 120.872 -1.142 . . . . 2.77 110.711 -179.246 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.527 HD23 ' C ' ' A' ' 3' ' ' LEU . 7.0 tt . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 121.273 0.558 . . . . 1.69 110.685 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.629 HG13 HD22 ' A' ' 5' ' ' LEU . 6.3 p -58.83 -39.4 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.677 -0.639 . . . . 1.52 110.379 -179.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.629 HD22 HG13 ' A' ' 4' ' ' VAL . 3.9 mm? -58.97 -46.2 88.68 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.733 -0.605 . . . . 1.92 110.426 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.443 ' O ' HG22 ' A' ' 9' ' ' VAL . 44.0 m-85 -60.0 -40.05 87.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 3.87 110.627 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.837 ' O ' HG23 ' A' ' 11' ' ' VAL . 99.5 m-20 -60.22 -40.1 88.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.255 -0.903 . . . . 1.35 110.553 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -60.05 -49.98 75.53 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.452 -0.78 . . . . 2.93 111.083 -179.009 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.862 HG12 ' HB3' ' A' ' 39' ' ' LEU . 32.6 m -67.6 -39.95 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 119.383 -0.927 . . . . 1.07 108.913 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.407 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -61.89 -38.14 87.2 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.708 -0.62 . . . . 0.42 111.276 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.837 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.5 t -59.99 -50.02 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.803 . . . . 0.95 110.465 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.406 ' HB3' ' HB2' ' A' ' 36' ' ' LEU . 97.8 mm-40 -60.28 -50.05 75.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.101 -1.04 . . . . 1.84 109.081 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.415 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -41.48 -56.24 3.55 Favored Glycine 0 N--CA 1.509 3.545 0 N-CA-C 110.282 -1.127 . . . . 0.36 110.282 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -61.6 -40.04 93.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.866 -0.785 . . . . 1.12 110.316 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 11' ' ' VAL . 91.9 t -59.7 -39.26 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.427 -0.796 . . . . 0.46 109.307 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.9 t -59.92 -50.06 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 N-CA-C 108.593 -0.891 . . . . 0.7 108.593 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.1 ttt85 -60.27 -41.42 93.23 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.742 -0.599 . . . . 3.15 110.178 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.6 -39.94 90.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.573 -0.705 . . . . 2.23 110.573 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.557 HD23 ' HD3' ' A' ' 22' ' ' LYS . 86.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.532 -0.73 . . . . 1.02 110.104 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HD3' HG21 ' A' ' 29' ' ' VAL . 10.5 mmtp -69.1 -40.05 78.6 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.574 0.702 . . . . 2.08 109.24 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.08 -33.56 72.24 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.105 -0.702 . . . . 0.81 109.105 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.557 ' HD3' HD23 ' A' ' 19' ' ' LEU . 14.2 ptmt -91.39 17.57 8.31 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.701 -0.8 . . . . 2.11 110.946 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt 59.59 22.38 11.04 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.359 -0.838 . . . . 2.28 111.329 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.91 151.55 23.86 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.44 -0.788 . . . . 0.71 110.26 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -69.09 170.71 15.15 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.411 1.216 . . . . 0.93 111.032 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.9 -32.63 67.91 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.195 0.521 . . . . 2.0 110.5 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -59.23 -39.97 84.41 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.6 -0.688 . . . . 2.22 111.169 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.521 ' HB3' HD22 ' A' ' 19' ' ' LEU . 80.0 m-20 -70.16 -40.57 74.66 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.414 -0.804 . . . . 1.46 110.639 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.506 HG21 ' HD3' ' A' ' 20' ' ' LYS . 83.6 t -68.57 -52.17 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.653 -0.654 . . . . 0.65 110.438 -179.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.458 ' O ' HG12 ' A' ' 33' ' ' VAL . 79.0 m-20 -60.07 -43.85 95.16 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.59 -0.694 . . . . 1.33 110.716 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.03 -47.49 86.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.448 -0.782 . . . . 0.46 110.377 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.54 -44.75 89.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.599 -0.688 . . . . 0.39 110.365 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.458 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.52 -38.21 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 108.143 -1.058 . . . . 0.57 108.143 178.852 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -60.0 -42.04 93.39 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.126 -1.064 . . . . 2.82 108.126 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -62.94 -47.16 84.42 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.353 -0.981 . . . . 1.73 108.353 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.538 ' O ' HD12 ' A' ' 36' ' ' LEU . 2.5 tp -60.01 -41.31 91.89 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.831 -0.622 . . . . 1.53 109.503 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.19 -38.36 79.64 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.59 -0.694 . . . . 1.36 109.614 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.9 t -60.77 -41.14 94.91 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.089 -0.708 . . . . 1.31 109.089 178.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 9' ' ' VAL . 63.3 mt -63.07 -50.18 71.6 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.467 -0.938 . . . . 0.72 108.467 178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.02 -40.01 87.79 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.653 0.74 . . . . 2.38 109.341 177.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -49.31 78.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.867 -0.521 . . . . 0.69 110.958 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -49.28 78.28 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.215 -0.928 . . . . 1.9 109.979 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.09 -37.01 78.68 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.572 0.701 . . . . 2.03 109.991 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.98 -40.0 87.65 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.681 -0.637 . . . . 2.12 111.297 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.08 -38.25 73.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.464 -0.773 . . . . 2.41 111.257 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.82 -55.17 36.2 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.267 -0.895 . . . . 2.31 110.849 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 47' ' ' THR . 29.7 m -158.45 16.85 0.21 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.277 -0.889 . . . . 2.51 111.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.87 37.8 75.23 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.433 -1.467 . . . . 1.86 109.433 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' O ' ' A' ' 50' ' ' GLU . 14.3 mm100 -81.5 -29.27 33.69 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.62 -0.93 . . . . 2.7 110.795 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 49' ' ' GLN . 8.5 pt-20 40.56 -172.47 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.505 0.669 . . . . 2.37 112.543 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.401 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.0 t80 . . . . . 0 N--CA 1.498 1.972 0 O-C-N 121.169 -0.957 . . . . 2.77 110.857 -179.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.1 tp . . . . . 0 N--CA 1.501 2.083 0 CA-C-O 121.084 0.469 . . . . 1.69 111.57 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 5' ' ' LEU . 10.5 p -59.02 -41.96 84.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.549 -0.719 . . . . 1.52 110.861 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.45 ' N ' HG13 ' A' ' 4' ' ' VAL . 2.6 mm? -59.97 -40.6 89.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.598 -0.689 . . . . 1.92 109.936 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.41 ' HH ' ' HH ' ' A' ' 51' ' ' TYR . 64.9 t80 -60.02 -40.0 87.8 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.479 -0.763 . . . . 3.87 109.883 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.655 ' O ' HG23 ' A' ' 11' ' ' VAL . 74.5 m-20 -59.97 -40.0 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.476 -0.765 . . . . 1.35 109.804 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -60.03 -50.43 73.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.585 -0.697 . . . . 2.93 111.269 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.675 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.0 m -70.02 -40.9 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.225 -0.922 . . . . 1.07 109.575 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.423 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -61.13 -44.69 96.94 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.612 -0.68 . . . . 0.42 111.227 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 7' ' ' ASN . 56.3 t -60.06 -46.7 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.384 -0.823 . . . . 0.95 110.362 -178.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.1 tp-100 -60.03 -49.13 78.88 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.118 -0.989 . . . . 1.84 109.347 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.474 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -39.47 -48.87 3.02 Favored Glycine 0 N--CA 1.51 3.631 0 N-CA-C 110.18 -1.168 . . . . 0.36 110.18 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.38 -34.38 78.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.879 -0.777 . . . . 1.12 110.873 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.71 -43.66 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.284 -0.885 . . . . 0.46 109.264 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.569 HG13 HG13 ' A' ' 29' ' ' VAL . 55.9 t -60.47 -45.51 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 N-CA-C 107.911 -1.144 . . . . 0.7 107.911 177.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -60.32 -40.02 89.11 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 116.04 -0.527 . . . . 3.15 110.879 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.97 -42.5 94.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.48 -0.763 . . . . 2.23 109.93 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 22' ' ' LYS . 89.1 mt -60.4 -40.18 90.0 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.493 0.663 . . . . 1.02 110.612 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.689 ' HE2' HG11 ' A' ' 29' ' ' VAL . 20.7 mmtt -68.67 -39.99 80.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.392 -0.818 . . . . 2.08 109.052 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -30.86 69.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.073 -0.714 . . . . 0.81 109.073 178.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.448 ' HG2' ' HA ' ' A' ' 19' ' ' LEU . 17.7 ptpt -94.31 19.33 9.62 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.771 -0.771 . . . . 2.11 110.773 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? 56.9 24.47 9.36 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.423 -0.798 . . . . 2.28 111.082 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.86 59.62 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.66 -0.65 . . . . 0.71 110.369 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.71 159.38 51.44 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.473 1.249 . . . . 0.93 110.684 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -55.17 -27.53 46.34 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.672 -0.642 . . . . 2.0 109.611 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -59.32 -40.12 85.26 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.787 -0.571 . . . . 2.22 110.047 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' 19' ' ' LEU . 74.3 m-20 -70.73 -45.52 64.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.535 -0.728 . . . . 1.46 110.006 179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.689 HG11 ' HE2' ' A' ' 20' ' ' LYS . 66.9 t -67.31 -40.49 84.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.737 -0.602 . . . . 0.65 109.801 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.425 ' O ' HG12 ' A' ' 33' ' ' VAL . 77.9 m-20 -60.07 -49.01 79.34 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.596 -0.69 . . . . 1.33 110.943 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.19 91.14 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.191 -0.943 . . . . 0.46 110.562 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.27 89.02 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.39 110.837 -179.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.499 ' O ' HD23 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -66.25 -39.49 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.239 -0.913 . . . . 0.57 108.646 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -60.2 -40.88 91.62 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.173 -1.047 . . . . 2.82 108.173 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -65.72 -44.68 85.3 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.126 -1.064 . . . . 1.73 108.126 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 39' ' ' LEU . 14.4 tp -59.06 -48.86 80.07 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 115.54 -0.754 . . . . 1.53 110.176 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.544 HD13 ' HD2' ' A' ' 40' ' ' LYS . 4.1 mm? -58.4 -37.46 75.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.318 -0.864 . . . . 1.36 109.657 179.093 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -59.97 -36.76 77.83 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.545 -0.722 . . . . 1.31 109.339 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.675 ' HB3' HG12 ' A' ' 9' ' ' VAL . 94.0 mt -59.95 -41.49 91.99 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.505 -0.747 . . . . 0.72 109.283 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.544 ' HD2' HD13 ' A' ' 37' ' ' LEU . 98.3 mttt -62.7 -40.44 97.13 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 120.149 -0.62 . . . . 2.38 109.511 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -40.61 89.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.79 -0.569 . . . . 0.69 110.498 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -60.15 -48.7 80.64 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.517 -0.739 . . . . 1.9 109.639 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -60.04 -40.44 89.39 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 2.03 110.031 179.142 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.435 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 97.9 mttt -62.71 -23.85 67.36 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.725 -0.609 . . . . 2.12 111.979 -179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.07 -39.97 79.87 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.272 -0.893 . . . . 2.41 111.014 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.611 ' O ' HG23 ' A' ' 47' ' ' THR . 42.1 mmtm -64.26 -56.14 16.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.538 -0.726 . . . . 2.31 110.657 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 46' ' ' LYS . 0.2 OUTLIER -163.21 27.28 0.09 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.461 -0.774 . . . . 2.51 110.804 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.435 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 71.62 41.1 57.92 Favored Glycine 0 N--CA 1.497 2.737 0 C-N-CA 120.012 -1.09 . . . . 1.86 110.387 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 70.7 mt-30 -83.45 -23.01 32.44 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.31 -1.112 . . . . 2.7 110.897 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 36.7 -157.55 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 112.602 0.593 . . . . 2.37 112.602 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.41 ' HH ' ' HH ' ' A' ' 6' ' ' TYR . 64.8 t80 . . . . . 0 N--CA 1.5 2.027 0 O-C-N 121.364 -0.835 . . . . 2.77 110.46 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.532 HD23 ' C ' ' A' ' 3' ' ' LEU . 10.5 tt . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 121.567 0.699 . . . . 1.69 110.005 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 70.0 t -58.8 -49.29 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.864 -0.523 . . . . 1.52 110.062 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.99 -39.99 87.62 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.658 . . . . 1.92 110.625 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -58.68 -40.98 85.14 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.44 -0.787 . . . . 3.87 110.59 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.9 m-80 -60.44 -40.38 90.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.612 -0.68 . . . . 1.35 111.421 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -59.97 -53.05 62.42 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.284 -0.885 . . . . 2.93 110.738 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.863 HG12 ' HB3' ' A' ' 39' ' ' LEU . 28.8 m -69.87 -40.06 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.587 -0.696 . . . . 1.07 109.763 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.443 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.15 -43.58 95.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.757 -0.589 . . . . 0.42 111.464 179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.4 t -59.96 -49.23 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.422 -0.799 . . . . 0.95 110.406 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -59.98 -50.14 74.92 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.023 -1.048 . . . . 1.84 109.47 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.648 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -38.77 -49.47 2.51 Favored Glycine 0 N--CA 1.509 3.521 0 N-CA-C 110.654 -0.978 . . . . 0.36 110.654 -178.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -64.53 -37.6 88.12 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.868 -0.783 . . . . 1.12 110.979 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.94 -40.06 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.407 -0.808 . . . . 0.46 109.815 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.472 HG22 ' CB ' ' A' ' 32' ' ' ALA . 83.1 t -59.92 -50.34 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.938 . . . . 0.7 108.826 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -62.53 -40.01 95.41 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.553 0.692 . . . . 3.15 109.783 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.0 tp10 -59.95 -42.44 94.04 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.863 -0.523 . . . . 2.23 111.341 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.727 HD13 ' HB3' ' A' ' 28' ' ' ASP . 89.8 mt -59.95 -44.88 94.12 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.777 0.799 . . . . 1.02 109.928 -179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.749 ' HD2' HG13 ' A' ' 29' ' ' VAL . 17.3 mtpt -69.97 -37.49 75.81 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.497 -0.927 . . . . 2.08 108.497 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.48 70.9 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.708 -0.849 . . . . 0.81 108.708 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.541 ' HE2' HD23 ' A' ' 19' ' ' LEU . 43.8 pttt -93.91 20.93 7.14 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 119.552 -0.859 . . . . 2.11 110.611 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt 60.05 20.38 9.54 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.532 -0.73 . . . . 2.28 111.926 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.521 ' HB2' ' CE ' ' A' ' 22' ' ' LYS . . . -58.19 163.06 4.91 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.424 -0.798 . . . . 0.71 110.614 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -76.77 166.52 26.89 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.449 1.236 . . . . 0.93 111.128 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -58.21 -28.27 64.67 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.736 -0.603 . . . . 2.0 111.316 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -57.67 -40.07 78.54 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.143 -0.973 . . . . 2.22 110.423 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.727 ' HB3' HD13 ' A' ' 19' ' ' LEU . 10.3 m-20 -71.84 -39.98 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.68 0.752 . . . . 1.46 109.52 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.749 HG13 ' HD2' ' A' ' 20' ' ' LYS . 61.1 t -66.95 -53.36 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-N 116.224 -0.444 . . . . 0.65 110.439 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' HG12 ' A' ' 33' ' ' VAL . 86.7 m-20 -59.95 -48.0 83.5 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.567 -0.708 . . . . 1.33 111.269 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.98 83.64 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.298 -0.877 . . . . 0.46 110.519 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.472 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -66.43 -40.01 89.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.647 -0.658 . . . . 0.39 110.554 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.99 -40.04 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.489 -0.884 . . . . 0.57 108.73 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.15 -40.29 93.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.046 -1.062 . . . . 2.82 108.364 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -66.12 -47.16 75.06 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.806 -0.812 . . . . 1.73 108.806 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.648 HD22 ' HA2' ' A' ' 13' ' ' GLY . 3.6 tp -60.06 -43.73 95.22 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.95 -0.469 . . . . 1.53 110.062 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.1 mt -59.98 -39.13 84.61 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.489 -0.757 . . . . 1.36 109.714 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.6 m -60.0 -39.53 86.09 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.271 -0.641 . . . . 1.31 109.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.863 ' HB3' HG12 ' A' ' 9' ' ' VAL . 81.9 mt -60.21 -55.45 33.58 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.435 -0.79 . . . . 0.72 109.91 179.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.555 ' HE3' HD11 ' A' ' 36' ' ' LEU . 98.4 mttt -60.91 -38.56 86.15 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.482 -0.762 . . . . 2.38 109.65 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.65 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 120.433 -0.507 . . . . 0.69 110.592 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.13 -50.95 71.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.124 -0.985 . . . . 1.9 109.792 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -63.54 -39.2 93.8 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.749 0.785 . . . . 2.03 109.801 178.776 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -60.01 -39.29 85.32 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.872 -0.518 . . . . 2.12 111.013 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -55.44 -37.77 68.15 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.422 -0.799 . . . . 2.41 111.023 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -63.07 -56.4 17.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.253 -0.905 . . . . 2.31 111.322 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.598 HG22 ' O ' ' A' ' 47' ' ' THR . 34.5 m -157.14 18.14 0.29 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.295 -0.878 . . . . 2.51 111.848 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.76 52.25 30.53 Favored Glycine 0 N--CA 1.496 2.655 0 N-CA-C 108.679 -1.769 . . . . 1.86 108.679 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.468 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 90.3 mm-40 -76.63 -37.64 56.01 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.888 . . . . 2.7 111.472 -178.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 32.7 96.83 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.963 0 N-CA-C 112.711 0.634 . . . . 2.37 112.711 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 41.0 p90 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 120.911 -1.118 . . . . 2.77 110.467 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.216 0.531 . . . . 3.98 110.481 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.0 p -65.45 -25.75 67.65 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.708 -0.62 . . . . 1.95 110.26 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.3 OUTLIER -62.39 -39.99 95.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.52 -0.738 . . . . 1.69 110.534 -179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.97 -49.93 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.327 -0.858 . . . . 1.52 109.626 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 5' ' ' LEU . 4.5 mm? -60.0 -33.3 71.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.468 -0.77 . . . . 1.92 109.214 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -48.61 79.61 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.473 0.654 . . . . 3.87 110.069 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.786 ' O ' HG23 ' A' ' 11' ' ' VAL . 31.2 m120 -61.78 -40.04 93.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.724 -0.61 . . . . 1.35 112.017 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.414 ' HG2' HD13 ' A' ' 39' ' ' LEU . 41.7 ttt180 -59.98 -51.69 68.6 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.26 -0.9 . . . . 2.93 111.7 -177.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.421 HG13 ' N ' ' A' ' 10' ' ' ALA . 11.5 p -66.87 -40.0 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.126 -0.984 . . . . 1.07 109.389 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.421 ' N ' HG13 ' A' ' 9' ' ' VAL . . . -59.94 -40.92 90.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.737 -0.602 . . . . 0.42 111.081 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.7 t -60.28 -50.02 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.464 -0.772 . . . . 0.95 110.644 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -62.85 -51.79 65.65 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.17 -0.957 . . . . 1.84 109.739 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.1 -51.6 2.73 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.593 -1.003 . . . . 0.36 110.593 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -64.55 -39.02 92.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.899 -0.765 . . . . 1.12 111.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 11' ' ' VAL . 75.8 t -59.79 -42.75 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.345 -0.847 . . . . 0.46 109.693 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.427 HG21 ' HA ' ' A' ' 33' ' ' VAL . 54.5 t -60.01 -48.98 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.7 109.819 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.0 -42.31 94.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.719 -0.613 . . . . 3.15 110.622 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -61.26 -48.26 82.27 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.605 -0.685 . . . . 2.23 111.244 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.2 mt -60.0 -42.11 93.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.675 -0.64 . . . . 1.02 111.298 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' CD ' HG21 ' A' ' 29' ' ' VAL . 30.4 tptt -63.99 -40.02 95.42 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.479 -0.934 . . . . 2.08 108.479 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.48 67.71 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.607 -0.886 . . . . 0.81 108.607 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 36.1 mtpt -85.08 8.92 16.29 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.741 -0.599 . . . . 2.11 110.986 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 55.7 mtmt 58.64 21.54 8.87 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.204 -0.935 . . . . 2.28 110.894 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -57.66 166.46 1.8 Allowed Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.562 -0.711 . . . . 0.71 110.418 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 43.5 Cg_endo -68.76 161.26 46.19 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.436 1.23 . . . . 0.93 110.207 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -56.84 -29.53 62.92 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.557 -0.715 . . . . 2.0 110.63 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.66 -39.88 85.9 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.533 -0.73 . . . . 2.22 110.988 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.07 -44.57 68.86 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 1.46 110.589 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.507 HG21 ' CD ' ' A' ' 20' ' ' LYS . 96.9 t -68.6 -48.56 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.713 -0.617 . . . . 0.65 110.256 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.5 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.9 m-20 -60.04 -49.49 77.45 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.509 -0.744 . . . . 1.33 111.503 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.77 84.21 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.14 -0.975 . . . . 0.46 110.427 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -64.76 -41.13 96.13 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 120.296 -0.561 . . . . 0.39 110.803 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.07 -37.13 79.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.257 -1.016 . . . . 0.57 108.257 179.903 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.24 -40.08 88.99 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.924 -0.769 . . . . 2.82 108.924 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.37 -50.68 72.64 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.883 -0.511 . . . . 1.73 110.219 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.483 HD12 ' C ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -60.21 -38.42 83.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.605 -0.684 . . . . 1.53 109.669 179.431 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.57 HD23 ' HE2' ' A' ' 40' ' ' LYS . 12.7 mt -58.0 -41.31 82.79 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.541 -0.724 . . . . 1.36 109.986 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.8 m -60.27 -39.98 88.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.577 -0.702 . . . . 1.31 109.326 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.414 HD13 ' HG2' ' A' ' 8' ' ' ARG . 43.2 mt -67.82 -43.21 80.12 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.007 -0.677 . . . . 0.72 109.279 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.57 ' HE2' HD23 ' A' ' 37' ' ' LEU . 36.5 ttpt -60.01 -39.19 84.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.74 -0.6 . . . . 2.38 109.921 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -42.16 91.93 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.262 -0.575 . . . . 0.69 110.453 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.14 -41.39 98.22 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.332 -0.855 . . . . 1.9 109.875 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -40.46 89.58 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.953 0.882 . . . . 2.03 109.541 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -60.03 -34.17 73.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.905 -0.497 . . . . 2.12 111.177 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -56.1 -40.01 73.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.563 -0.711 . . . . 2.41 111.834 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -62.2 -57.83 10.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.085 -1.009 . . . . 2.31 111.329 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.3 m -156.21 25.16 0.36 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.135 -0.978 . . . . 2.51 111.155 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.95 36.27 64.95 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.607 -0.997 . . . . 1.86 110.607 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -85.18 -15.85 42.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.402 -1.058 . . . . 2.7 111.43 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 38.05 -166.37 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.009 0.744 . . . . 2.37 113.009 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.4 ' CD1' HG22 ' A' ' 9' ' ' VAL . 45.3 t80 -71.83 105.09 3.66 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.184 -0.948 . . . . 2.77 110.207 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.7 mmtm -69.13 136.93 89.27 Favored Pre-proline 0 N--CA 1.493 1.697 0 N-CA-C 108.624 -0.88 . . . . 5.01 108.624 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -71.35 -177.47 2.41 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 O-C-N 123.159 1.084 . . . . 3.45 111.102 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.7 16.25 77.87 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 111.206 -0.758 . . . . 3.07 111.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 54.25 177.71 0.03 OUTLIER Pre-proline 0 N--CA 1.505 2.306 0 O-C-N 121.005 -1.291 . . . . 4.09 110.657 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.99 150.02 66.22 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.107 1.056 . . . . 4.1 110.463 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.318 -1.041 0 O-C-N 123.582 1.306 . . . . 4.82 110.829 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 46.0 t0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.878 0.371 . . . . 3.98 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.426 ' HB3' HD12 ' A' ' 5' ' ' LEU . 10.7 m -71.33 60.8 0.31 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.478 -0.764 . . . . 1.95 110.346 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tp -66.43 -40.0 89.25 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.563 -0.711 . . . . 1.69 110.393 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 86.9 t -59.95 -45.53 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.68 -0.638 . . . . 1.52 110.655 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.426 HD12 ' HB3' ' A' ' 2' ' ' SER . 86.9 mt -59.96 -39.95 87.35 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.374 -0.829 . . . . 1.92 109.868 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' A' ' 51' ' ' TYR . 2.5 m-85 -57.63 -38.54 75.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.685 -0.634 . . . . 3.87 109.947 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.816 ' O ' HG23 ' A' ' 11' ' ' VAL . 96.3 m-20 -60.05 -40.02 88.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.585 -0.697 . . . . 1.35 110.315 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 mtp85 -59.97 -50.99 71.59 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.373 -0.83 . . . . 2.93 110.886 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.783 ' HA ' HD13 ' A' ' 39' ' ' LEU . 25.1 m -69.54 -38.09 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 108.238 -1.023 . . . . 1.07 108.238 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.458 ' HB2' ' HD3' ' A' ' 56' ' ' PRO . . . -60.07 -39.33 85.66 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 116.098 -0.501 . . . . 0.42 110.543 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.6 t -60.03 -50.02 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.378 -0.826 . . . . 0.95 109.96 -179.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.44 -50.22 74.45 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.151 -0.968 . . . . 1.84 109.392 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.67 -55.49 3.23 Favored Glycine 0 N--CA 1.507 3.388 0 N-CA-C 110.143 -1.183 . . . . 0.36 110.143 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -65.0 -35.61 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.934 -0.745 . . . . 1.12 110.854 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 11' ' ' VAL . 86.0 t -60.01 -40.0 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 121.263 -0.898 . . . . 0.46 109.666 -179.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.02 -49.0 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 N-CA-C 108.902 -0.777 . . . . 0.7 108.902 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.8 ttp85 -60.32 -43.12 96.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.866 -0.521 . . . . 3.15 110.444 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.99 -41.7 97.42 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.41 -0.806 . . . . 2.23 111.406 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.76 -40.51 92.74 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.42 -0.8 . . . . 1.02 110.424 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' CD ' HG21 ' A' ' 29' ' ' VAL . 39.7 tptt -67.2 -40.09 86.43 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.127 -0.694 . . . . 2.08 109.127 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.46 -26.26 66.63 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.739 -0.837 . . . . 0.81 108.739 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -86.22 9.18 18.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.725 -0.609 . . . . 2.11 110.391 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 56.7 21.37 5.83 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.279 -0.888 . . . . 2.28 111.073 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.443 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -59.24 163.56 5.99 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.586 -0.696 . . . . 0.71 109.933 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.443 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 42.3 Cg_endo -67.82 162.32 40.08 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 O-C-N 123.484 1.255 . . . . 0.93 111.292 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -55.28 -27.4 46.42 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.754 -0.591 . . . . 2.0 110.258 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -58.66 -40.0 82.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.62 -0.675 . . . . 2.22 110.461 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -71.15 -45.35 63.71 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -0.81 . . . . 1.46 110.869 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.507 HG21 ' CD ' ' A' ' 20' ' ' LYS . 82.5 t -68.55 -50.0 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.497 -0.752 . . . . 0.65 110.164 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.445 ' O ' HG12 ' A' ' 33' ' ' VAL . 71.4 m-20 -59.98 -46.16 90.34 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 1.33 110.871 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.39 82.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.255 -0.903 . . . . 0.46 110.404 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.15 -42.26 89.28 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 120.086 -0.645 . . . . 0.39 110.496 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.505 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -65.93 -39.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 N-CA-C 108.358 -0.978 . . . . 0.57 108.358 179.331 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -61.06 -42.28 98.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.997 -1.112 . . . . 2.82 107.997 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -65.32 -42.45 92.98 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.833 -1.173 . . . . 1.73 107.833 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.505 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 15.4 tp -60.03 -46.63 88.89 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.737 -0.665 . . . . 1.53 110.0 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.42 -38.4 80.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.272 -0.892 . . . . 1.36 109.575 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 t -59.74 -34.51 73.04 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.644 . . . . 1.31 109.633 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.783 HD13 ' HA ' ' A' ' 9' ' ' VAL . 93.0 mt -60.0 -48.91 79.76 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.473 -0.767 . . . . 0.72 109.5 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.93 -39.93 91.28 Favored 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.774 0.797 . . . . 2.38 109.109 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -43.97 94.85 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 116.177 -0.465 . . . . 0.69 110.566 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.97 -50.68 72.81 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.302 -0.874 . . . . 1.9 109.655 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.421 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -64.47 -38.28 90.46 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.814 0.816 . . . . 2.03 109.718 178.591 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.9 tttp -60.0 -39.05 84.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.928 -0.483 . . . . 2.12 111.815 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -54.86 -39.03 68.21 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.386 -0.821 . . . . 2.41 112.003 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -62.58 -60.01 4.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.009 -1.057 . . . . 2.31 111.325 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.9 m -156.26 23.47 0.36 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.287 -0.883 . . . . 2.51 110.876 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.04 63.11 3.6 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 109.385 -1.486 . . . . 1.86 109.385 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 95.7 mm-40 -83.82 -41.5 17.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.495 -1.003 . . . . 2.7 111.823 -179.074 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 8.0 pt-20 33.54 92.14 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.86 0 CA-C-O 121.584 0.706 . . . . 2.37 112.113 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.406 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 53.3 p90 -51.04 154.1 1.65 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.107 -0.995 . . . . 2.77 111.248 -178.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.02 153.99 52.45 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.603 -0.686 . . . . 5.01 110.465 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -74.26 -17.13 21.83 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.393 1.207 . . . . 3.45 111.717 -178.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.85 33.01 3.6 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.825 -1.179 . . . . 3.07 112.056 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.414 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 2.1 m-20 54.62 177.35 0.03 OUTLIER Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 120.901 -1.352 . . . . 4.09 110.868 178.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.458 ' HD3' ' HB2' ' A' ' 10' ' ' ALA . 37.5 Cg_endo -69.96 150.04 66.42 Favored 'Trans proline' 0 N--CA 1.487 1.14 0 O-C-N 123.408 1.215 . . . . 4.1 111.193 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.319 -1.013 0 O-C-N 123.586 1.309 . . . . 4.82 110.285 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.464 -0.569 . . . . 3.98 109.464 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.1 m -71.42 58.49 0.27 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.448 -0.782 . . . . 1.95 110.302 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.13 -41.32 94.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.452 -0.78 . . . . 1.69 109.113 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.464 HG13 ' N ' ' A' ' 5' ' ' LEU . 9.9 p -58.02 -40.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 121.354 0.597 . . . . 1.52 110.531 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.464 ' N ' HG13 ' A' ' 4' ' ' VAL . 8.0 tt -60.02 -40.72 90.28 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.373 0.606 . . . . 1.92 110.183 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -59.52 -40.11 86.09 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.888 -0.508 . . . . 3.87 110.369 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.779 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.1 m-20 -63.21 -40.41 97.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 1.35 110.259 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -62.42 -49.63 74.71 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.13 -0.981 . . . . 2.93 112.106 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.933 HG12 ' HB3' ' A' ' 39' ' ' LEU . 26.6 m -64.83 -42.81 95.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.02 -1.05 . . . . 1.07 110.654 -179.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.454 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -62.24 -40.76 97.24 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.39 -0.819 . . . . 0.42 111.689 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 7' ' ' ASN . 73.5 t -60.09 -47.68 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.454 -0.779 . . . . 0.95 111.132 -177.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HG3' HD11 ' A' ' 39' ' ' LEU . 30.0 mm100 -60.61 -48.17 82.95 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 119.245 -0.982 . . . . 1.84 109.553 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -38.6 -56.81 1.97 Allowed Glycine 0 N--CA 1.511 3.688 0 N-CA-C 110.175 -1.17 . . . . 0.36 110.175 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.58 -38.49 91.33 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.977 -0.719 . . . . 1.12 111.004 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 11' ' ' VAL . 93.1 t -59.87 -44.4 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.816 . . . . 0.46 109.427 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.548 HG22 ' CB ' ' A' ' 32' ' ' ALA . 63.9 t -59.98 -44.99 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 108.386 -0.968 . . . . 0.7 108.386 177.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -60.45 -41.57 94.35 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.875 -0.515 . . . . 3.15 111.069 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -64.16 -44.51 91.86 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.345 -0.847 . . . . 2.23 111.445 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.32 -41.96 97.88 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.536 -0.727 . . . . 1.02 111.097 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.463 ' CD ' HG21 ' A' ' 29' ' ' VAL . 39.3 tptt -63.93 -40.02 95.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.361 -0.837 . . . . 2.08 108.993 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.8 67.22 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.58 -0.896 . . . . 0.81 108.58 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 66.0 mttm -84.37 7.38 19.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.729 -0.607 . . . . 2.11 110.852 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 25.9 mmtp 59.28 20.14 8.29 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.172 -0.955 . . . . 2.28 110.938 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.76 162.3 9.6 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.613 -0.68 . . . . 0.71 109.822 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.2 166.48 28.0 Favored 'Trans proline' 0 C--N 1.314 -1.237 0 O-C-N 123.33 1.174 . . . . 0.93 111.133 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.1 -26.87 51.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.747 -0.596 . . . . 2.0 111.005 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.6 -40.04 86.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.478 -0.763 . . . . 2.22 110.557 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.45 -45.93 57.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 1.46 110.933 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.463 HG21 ' CD ' ' A' ' 20' ' ' LYS . 88.8 t -63.89 -49.89 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.498 -0.751 . . . . 0.65 109.461 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -60.0 -44.92 94.24 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.742 -0.599 . . . . 1.33 111.025 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -50.03 75.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.405 -0.809 . . . . 0.46 110.564 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.548 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -63.38 -45.92 88.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.659 -0.651 . . . . 0.39 110.21 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -35.63 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.28 -1.007 . . . . 0.57 108.28 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -59.94 -43.93 94.68 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.45 -0.944 . . . . 2.82 108.45 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? -64.37 -47.44 79.28 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.356 -0.979 . . . . 1.73 108.356 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 tp -59.95 -40.4 88.87 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 115.613 -0.722 . . . . 1.53 110.032 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.6 mt -59.56 -37.41 78.4 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.538 -0.726 . . . . 1.36 109.919 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.7 m -59.84 -40.11 87.42 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.556 -0.715 . . . . 1.31 109.522 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.933 ' HB3' HG12 ' A' ' 9' ' ' VAL . 54.7 mt -63.95 -54.84 28.24 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.036 -0.727 . . . . 0.72 109.036 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.85 -34.65 74.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.565 0.698 . . . . 2.38 109.404 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.454 ' HA ' ' HG2' ' A' ' 44' ' ' LYS . . . -59.88 -38.78 83.19 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.845 -0.535 . . . . 0.69 110.299 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -40.82 84.59 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.24 -0.913 . . . . 1.9 109.884 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -60.39 -45.93 91.8 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.584 -0.698 . . . . 2.03 111.389 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 41' ' ' ALA . 1.0 OUTLIER -61.38 -19.12 61.52 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.327 -0.858 . . . . 2.12 112.034 -178.487 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -59.35 -39.98 84.96 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.365 -0.834 . . . . 2.41 110.745 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.23 -57.42 10.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.575 -0.703 . . . . 2.31 111.092 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.555 ' O ' HG22 ' A' ' 47' ' ' THR . 40.2 m -151.51 19.29 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.236 -0.915 . . . . 2.51 110.776 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.4 39.31 80.68 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.656 -1.378 . . . . 1.86 109.656 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 50' ' ' GLU . 96.6 mm-40 -90.2 -15.39 31.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.606 -0.937 . . . . 2.7 112.2 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' O ' ' A' ' 49' ' ' GLN . 14.8 pt-20 39.75 -176.33 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.608 0 N-CA-C 113.274 0.842 . . . . 2.37 113.274 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -75.27 70.74 2.22 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.944 -1.098 . . . . 2.77 110.724 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.6 mttp -68.4 150.61 97.64 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 5.01 109.278 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -69.78 -58.3 0.1 Allowed 'Trans proline' 0 C--N 1.318 -1.034 0 O-C-N 123.23 1.121 . . . . 3.45 110.305 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -82.83 48.85 4.09 Favored Glycine 0 N--CA 1.49 2.247 0 C-N-CA 119.517 -1.325 . . . . 3.07 110.227 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -143.75 59.45 7.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.291 -1.123 . . . . 4.09 110.222 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -69.98 150.01 66.26 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.743 1.391 . . . . 4.1 110.542 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 C--N 1.318 -1.075 0 O-C-N 123.306 1.161 . . . . 4.82 110.413 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.065 0.46 . . . . 3.98 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m -64.12 -40.92 97.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.585 -0.697 . . . . 1.95 110.71 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.6 tp -62.42 -42.4 99.42 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.509 -0.744 . . . . 1.69 109.807 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.75 -46.66 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 C-N-CA 120.441 -0.503 . . . . 1.52 109.872 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -42.51 93.31 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.313 -0.867 . . . . 1.92 109.343 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.495 ' O ' HG22 ' A' ' 9' ' ' VAL . 4.5 t80 -59.89 -39.93 87.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.67 -0.644 . . . . 3.87 110.15 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.733 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.5 m-20 -60.03 -39.98 87.76 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.29 -0.882 . . . . 1.35 110.286 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -59.99 -47.3 86.37 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.689 -0.632 . . . . 2.93 110.892 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.885 ' HA ' HD13 ' A' ' 39' ' ' LEU . 33.1 m -69.12 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.122 -0.986 . . . . 1.07 109.434 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.629 ' HB2' ' HD3' ' A' ' 56' ' ' PRO . . . -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.527 -0.733 . . . . 0.42 110.486 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 7' ' ' ASN . 52.4 t -59.96 -49.04 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.737 -0.602 . . . . 0.95 110.756 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.508 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -60.02 -50.09 75.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.479 -0.763 . . . . 1.84 109.577 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.645 ' HA2' HD13 ' A' ' 36' ' ' LEU . . . -41.93 -55.01 4.23 Favored Glycine 0 N--CA 1.507 3.368 0 N-CA-C 110.49 -1.044 . . . . 0.36 110.49 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -63.34 -35.26 79.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.844 -0.797 . . . . 1.12 111.923 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 11' ' ' VAL . 72.5 t -59.99 -43.58 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.23 -0.919 . . . . 0.46 109.828 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.687 HG11 HG23 ' A' ' 33' ' ' VAL . 62.5 t -59.99 -44.53 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.457 -0.777 . . . . 0.7 109.597 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.675 -0.641 . . . . 3.15 110.806 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.01 -44.03 94.82 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.441 -0.787 . . . . 2.23 111.414 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.495 HD23 ' HB3' ' A' ' 28' ' ' ASP . 4.6 mp -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.328 -0.858 . . . . 1.02 110.337 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.594 ' CD ' HG21 ' A' ' 29' ' ' VAL . 10.7 tptt -62.58 -39.97 95.38 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.196 -0.668 . . . . 2.08 109.196 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.3 -25.48 67.14 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.583 -0.895 . . . . 0.81 108.583 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.29 6.86 24.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.747 -0.596 . . . . 2.11 110.399 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 55.41 25.82 8.11 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.231 -0.918 . . . . 2.28 110.812 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.601 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -58.47 170.33 0.81 Allowed Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.761 -0.587 . . . . 0.71 110.061 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.601 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 45.4 Cg_endo -71.26 154.85 61.42 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.33 1.174 . . . . 0.93 110.012 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -54.47 -24.79 21.78 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.36 -0.837 . . . . 2.0 111.159 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.521 -0.737 . . . . 2.22 110.438 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.495 ' HB3' HD23 ' A' ' 19' ' ' LEU . 68.4 m-20 -72.6 -46.44 54.23 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.457 -0.777 . . . . 1.46 110.974 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.594 HG21 ' CD ' ' A' ' 20' ' ' LYS . 97.8 t -66.04 -49.72 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.648 -0.657 . . . . 0.65 110.608 -179.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.478 ' O ' HG12 ' A' ' 33' ' ' VAL . 75.1 m-20 -59.93 -50.92 71.87 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.388 -0.82 . . . . 1.33 111.625 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.46 90.02 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.038 -1.039 . . . . 0.46 110.399 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.5 ' HB1' HG22 ' A' ' 16' ' ' VAL . . . -65.3 -39.98 93.19 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 120.319 -0.552 . . . . 0.39 110.766 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.687 HG23 HG11 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -68.45 -38.89 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.217 -0.927 . . . . 0.57 109.26 179.594 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -60.0 -35.29 74.72 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.754 0.788 . . . . 2.82 109.113 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -59.95 -40.05 87.66 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.408 0.623 . . . . 1.73 109.587 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.645 HD13 ' HA2' ' A' ' 13' ' ' GLY . 35.3 mt -59.25 -40.03 84.69 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 120.115 -0.634 . . . . 1.53 109.706 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.499 HD12 ' N ' ' A' ' 37' ' ' LEU . 9.7 mp -58.99 -34.67 72.1 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.477 -0.764 . . . . 1.36 109.619 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 26.6 t -59.96 -39.98 87.46 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.903 -0.777 . . . . 1.31 108.903 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.885 HD13 ' HA ' ' A' ' 9' ' ' VAL . 92.2 mt -59.95 -49.98 75.53 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.629 -0.878 . . . . 0.72 108.629 178.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -62.2 -33.03 73.77 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.916 -0.772 . . . . 2.38 108.916 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 38' ' ' SER . . . -60.03 -43.01 95.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.69 109.748 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -61.26 -44.22 97.6 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.231 -1.026 . . . . 1.9 108.231 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.61 -41.2 94.34 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.545 0.688 . . . . 2.03 109.859 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -60.0 -36.35 77.0 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.714 -0.616 . . . . 2.12 111.486 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -56.27 -40.02 73.58 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.322 -0.861 . . . . 2.41 110.745 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.09 -62.83 1.23 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.701 -0.8 . . . . 2.31 110.795 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.2 t -165.78 29.39 0.05 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.303 -0.873 . . . . 2.51 111.613 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.05 63.87 3.42 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 109.136 -1.586 . . . . 1.86 109.136 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 99.6 mt-30 -83.11 -32.15 26.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.656 -0.909 . . . . 2.7 110.462 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 15.2 pt-20 32.31 98.48 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 113.38 0.881 . . . . 2.37 113.38 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -56.49 139.98 47.54 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.148 -0.97 . . . . 2.77 110.513 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttp -68.65 159.41 81.93 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 5.01 110.694 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.66 -4.82 16.0 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 O-C-N 123.467 1.246 . . . . 3.45 111.435 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -82.49 9.59 58.11 Favored Glycine 0 N--CA 1.496 2.665 0 C-N-CA 119.864 -1.16 . . . . 3.07 111.478 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.6 174.5 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.07 0 O-C-N 120.896 -1.355 . . . . 4.09 110.77 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.629 ' HD3' ' HB2' ' A' ' 10' ' ' ALA . 38.1 Cg_endo -69.99 150.02 66.22 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.55 1.289 . . . . 4.1 110.68 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo . . . . . 0 C--N 1.318 -1.077 0 O-C-N 123.565 1.297 . . . . 4.82 110.605 -179.355 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 50.7 p-10 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 120.979 0.418 . . . . 3.98 110.321 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.3 m -71.38 59.44 0.28 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.522 -0.736 . . . . 1.95 110.507 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.81 -44.35 97.03 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.659 0.742 . . . . 1.69 109.82 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.03 -41.93 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.928 -0.483 . . . . 1.52 111.146 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -59.98 -47.97 83.65 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.317 -0.864 . . . . 1.92 110.149 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.463 ' O ' HG22 ' A' ' 9' ' ' VAL . 8.1 m-85 -57.42 -38.31 74.16 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.522 -0.736 . . . . 3.87 110.418 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.741 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.6 m-20 -60.01 -40.08 88.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.522 -0.736 . . . . 1.35 110.563 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -60.02 -48.89 79.83 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.457 -0.777 . . . . 2.93 110.835 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.848 HG12 ' HB3' ' A' ' 39' ' ' LEU . 30.6 m -65.77 -39.92 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 C-N-CA 119.327 -0.949 . . . . 1.07 109.715 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -40.54 98.06 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.493 -0.754 . . . . 0.42 110.55 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 7' ' ' ASN . 65.8 t -60.66 -42.72 92.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.655 -0.653 . . . . 0.95 110.777 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -62.89 -56.44 17.29 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.132 -0.98 . . . . 1.84 109.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -37.71 -52.74 1.93 Allowed Glycine 0 N--CA 1.512 3.763 0 N-CA-C 110.717 -0.953 . . . . 0.36 110.717 -178.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -61.71 -38.73 88.94 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.976 -0.72 . . . . 1.12 110.941 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 11' ' ' VAL . 97.7 t -59.96 -40.18 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.324 -0.86 . . . . 0.46 110.023 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.416 HG22 ' HB3' ' A' ' 32' ' ' ALA . 71.8 t -60.04 -49.96 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 121.024 -1.047 . . . . 0.7 108.805 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 68.1 ttt-85 -60.07 -44.44 94.75 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 121.459 0.647 . . . . 3.15 110.167 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.14 -48.31 82.26 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.81 -0.556 . . . . 2.23 110.737 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.97 -46.07 90.62 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 120.043 -0.663 . . . . 1.02 110.105 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -66.31 -39.99 89.65 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.414 -0.958 . . . . 2.08 108.414 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.73 -30.55 70.84 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 108.675 -0.861 . . . . 0.81 108.675 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -85.6 10.72 12.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.44 -0.504 . . . . 2.11 110.873 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt 59.91 20.14 9.13 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.302 -0.874 . . . . 2.28 111.195 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -59.4 165.19 4.18 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.554 -0.716 . . . . 0.71 109.953 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 45.3 Cg_endo -70.61 160.55 49.08 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.32 1.168 . . . . 0.93 111.349 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.497 ' HA ' HG12 ' A' ' 29' ' ' VAL . 33.9 mtpt -55.83 -25.71 43.12 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.574 -0.704 . . . . 2.0 110.446 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -59.98 -39.91 87.3 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.152 -0.968 . . . . 2.22 109.953 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -70.0 -49.63 49.57 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.437 -0.789 . . . . 1.46 111.42 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.497 HG12 ' HA ' ' A' ' 26' ' ' LYS . 8.4 p -65.05 -43.25 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.406 -0.809 . . . . 0.65 110.221 -179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.434 ' O ' HG12 ' A' ' 33' ' ' VAL . 95.6 m-20 -60.03 -41.75 92.89 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.8 -0.562 . . . . 1.33 110.792 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.64 -50.11 72.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.447 -0.783 . . . . 0.46 110.797 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -65.46 -41.52 93.3 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 120.182 -0.607 . . . . 0.39 110.331 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.46 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -67.12 -38.87 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 107.412 -1.329 . . . . 0.57 107.412 178.498 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -60.43 -46.36 90.33 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.342 -0.984 . . . . 2.82 108.342 177.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -64.23 -40.92 97.04 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.095 -1.076 . . . . 1.73 108.095 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.598 ' HA ' HD12 ' A' ' 39' ' ' LEU . 17.2 tp -60.0 -40.33 88.84 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 115.626 -0.715 . . . . 1.53 110.322 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.54 HD23 ' HD3' ' A' ' 40' ' ' LYS . 77.5 mt -59.96 -40.0 87.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.219 -0.926 . . . . 1.36 109.722 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.3 m -60.44 -37.02 79.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.424 -0.798 . . . . 1.31 109.347 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.848 ' HB3' HG12 ' A' ' 9' ' ' VAL . 88.6 mt -59.98 -56.24 24.1 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.672 -0.643 . . . . 0.72 110.439 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.54 ' HD3' HD23 ' A' ' 37' ' ' LEU . 17.6 ptmt -62.11 -35.88 80.06 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.317 -0.865 . . . . 2.38 109.23 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -60.76 -43.77 97.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.112 -0.495 . . . . 0.69 110.488 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.04 -47.6 85.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.111 -0.993 . . . . 1.9 109.259 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.464 ' CE2' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -61.22 -38.7 87.54 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.498 -0.751 . . . . 2.03 109.042 178.081 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.8 ttpt -60.34 -27.27 67.23 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.749 -0.594 . . . . 2.12 111.081 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -55.6 -37.76 68.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.26 -0.9 . . . . 2.41 110.961 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -62.82 -77.71 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.443 -0.786 . . . . 2.31 110.014 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 t -161.49 40.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.31 -0.869 . . . . 2.51 110.241 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.71 65.75 2.4 Favored Glycine 0 N--CA 1.496 2.698 0 N-CA-C 109.972 -1.251 . . . . 1.86 109.972 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HB3' ' CE2' ' A' ' 43' ' ' TYR . 81.6 mm-40 -86.43 -21.75 26.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.467 -1.019 . . . . 2.7 111.608 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 9.0 pt-20 32.21 92.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 112.811 0.671 . . . . 2.37 112.811 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -57.7 138.43 55.45 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.126 -0.984 . . . . 2.77 110.716 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.4 ' HB2' ' HD2' ' A' ' 56' ' ' PRO . 18.1 mmtt -65.12 166.32 13.41 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.645 . . . . 5.01 109.414 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -62.24 -33.72 80.26 Favored 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.125 1.066 . . . . 3.45 111.228 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.86 -3.08 89.15 Favored Glycine 0 N--CA 1.493 2.495 0 C-N-CA 119.313 -1.423 . . . . 3.07 110.665 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.415 ' N ' ' CD ' ' A' ' 56' ' ' PRO . 69.3 m-80 49.52 49.94 8.3 Favored Pre-proline 0 N--CA 1.506 2.348 0 O-C-N 121.047 -1.266 . . . . 4.09 111.656 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.418 ' O ' ' CZ ' ' A' ' 6' ' ' TYR . 37.2 Cg_endo -70.05 149.97 65.8 Favored 'Trans proline' 0 N--CA 1.487 1.112 0 O-C-N 123.166 1.087 . . . . 4.1 110.991 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 N--CA 1.488 1.174 0 O-C-N 123.417 1.22 . . . . 4.82 110.616 179.256 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.426 ' O ' HG12 ' A' ' 4' ' ' VAL . 78.2 m-20 . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.374 0.607 . . . . 3.98 110.004 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m -66.99 -39.96 87.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.39 -0.819 . . . . 1.95 110.682 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.509 HD23 ' C ' ' A' ' 3' ' ' LEU . 7.9 tt -61.2 -50.95 71.05 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.485 -0.76 . . . . 1.69 112.474 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 5' ' ' LEU . 14.7 p -58.64 -39.5 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.089 -1.007 . . . . 1.52 110.251 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.612 HD12 ' CZ ' ' A' ' 43' ' ' TYR . 0.5 OUTLIER -58.93 -39.96 83.18 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 109.394 -0.595 . . . . 1.92 109.394 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.56 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 m-85 -59.11 -38.26 79.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.614 -0.679 . . . . 3.87 110.103 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.836 ' O ' HG23 ' A' ' 11' ' ' VAL . 58.9 m-20 -60.04 -40.75 90.48 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.14 -0.975 . . . . 1.35 109.938 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -60.01 -49.52 77.32 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.762 -0.586 . . . . 2.93 110.715 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.861 HG12 ' HB3' ' A' ' 39' ' ' LEU . 26.5 m -66.76 -39.46 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.391 -0.818 . . . . 1.07 109.565 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.685 ' HB1' ' OD1' ' A' ' 55' ' ' ASN . . . -60.51 -37.1 80.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.534 -0.728 . . . . 0.42 110.319 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.836 HG23 ' O ' ' A' ' 7' ' ' ASN . 64.2 t -60.01 -49.95 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.625 -0.672 . . . . 0.95 109.76 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.37 -56.13 21.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.353 -0.842 . . . . 1.84 109.876 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -36.42 -52.5 1.35 Allowed Glycine 0 N--CA 1.514 3.866 0 N-CA-C 110.907 -0.877 . . . . 0.36 110.907 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -62.26 -37.93 87.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.884 -0.774 . . . . 1.12 111.289 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 11' ' ' VAL . 76.2 t -59.52 -40.56 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.329 -0.857 . . . . 0.46 109.469 -178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.1 t -59.98 -49.6 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.4 -0.812 . . . . 0.7 109.004 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -60.0 -43.48 95.19 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.581 -0.699 . . . . 3.15 110.423 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -60.4 -39.5 87.57 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.481 -0.762 . . . . 2.23 111.255 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 28' ' ' ASP . 83.1 mt -60.02 -40.5 89.54 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.374 -0.829 . . . . 1.02 110.924 -178.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.522 ' HE2' HG21 ' A' ' 29' ' ' VAL . 14.3 mmtp -66.24 -40.26 90.1 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.35 -0.844 . . . . 2.08 109.326 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.39 66.93 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.171 -1.048 . . . . 0.81 108.171 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 48.7 mtpt -86.33 9.44 17.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.715 -0.616 . . . . 2.11 111.007 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 57.9 mtpt 58.08 24.77 11.6 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.28 -0.888 . . . . 2.28 110.822 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 157.99 40.65 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.777 -0.577 . . . . 0.71 110.3 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.52 167.44 27.03 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.433 1.228 . . . . 0.93 110.478 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -56.63 -31.86 64.76 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.732 -0.605 . . . . 2.0 109.778 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -59.71 -40.05 86.66 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.637 -0.664 . . . . 2.22 110.533 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.478 ' HB3' HD22 ' A' ' 19' ' ' LEU . 63.1 m-20 -69.81 -42.45 73.69 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.291 -0.881 . . . . 1.46 110.049 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.522 HG21 ' HE2' ' A' ' 20' ' ' LYS . 93.8 t -67.68 -48.95 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 CA-C-O 121.39 0.614 . . . . 0.65 109.773 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' O ' HG12 ' A' ' 33' ' ' VAL . 89.1 m-20 -59.92 -46.87 87.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.658 -0.652 . . . . 1.33 111.198 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.29 -47.72 84.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.333 -0.855 . . . . 0.46 110.758 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.75 -44.99 88.32 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.497 -0.752 . . . . 0.39 110.247 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.444 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -64.47 -38.51 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.031 -1.1 . . . . 0.57 108.031 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.06 -45.5 92.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 108.07 -1.085 . . . . 2.82 108.07 177.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -63.57 -43.15 97.84 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 122.117 0.961 . . . . 1.73 108.604 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 17.4 tp -59.96 -42.44 94.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.833 -0.621 . . . . 1.53 110.096 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.03 -38.72 83.55 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.499 -0.75 . . . . 1.36 110.384 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 p -59.98 -37.57 80.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.365 -0.835 . . . . 1.31 109.337 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.861 ' HB3' HG12 ' A' ' 9' ' ' VAL . 79.7 mt -62.23 -52.93 61.8 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.609 -0.886 . . . . 0.72 108.609 178.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.58 -38.37 84.37 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.42 0.629 . . . . 2.38 109.361 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.39 93.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.757 -0.59 . . . . 0.69 109.762 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -60.08 -44.9 94.43 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.617 -0.882 . . . . 1.9 108.617 178.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.612 ' CZ ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -60.19 -43.34 95.98 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.433 0.635 . . . . 2.03 110.101 178.358 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.54 -29.03 68.88 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.722 -0.611 . . . . 2.12 111.793 -179.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -55.97 -39.97 72.58 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.288 -0.882 . . . . 2.41 111.212 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.31 -64.39 0.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.397 -0.815 . . . . 2.31 110.79 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -165.94 32.79 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.383 -0.823 . . . . 2.51 110.994 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.59 70.58 1.2 Allowed Glycine 0 N--CA 1.498 2.788 0 N-CA-C 110.398 -1.081 . . . . 1.86 110.398 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 50' ' ' GLU . 22.5 mm100 -85.92 -28.01 24.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.537 -0.978 . . . . 2.7 110.405 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.492 ' O ' ' O ' ' A' ' 49' ' ' GLN . 16.2 pt-20 39.47 114.98 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 122.892 1.33 . . . . 2.37 113.088 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.572 ' CD1' HG23 ' A' ' 9' ' ' VAL . 13.9 t80 -55.9 131.47 47.15 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.844 -1.16 . . . . 2.77 110.668 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -69.55 154.51 94.76 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.771 -0.58 . . . . 5.01 109.488 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -80.34 -20.2 8.54 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.344 1.181 . . . . 3.45 111.55 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.05 32.57 3.76 Favored Glycine 0 N--CA 1.497 2.722 0 C-N-CA 119.87 -1.157 . . . . 3.07 112.4 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.685 ' OD1' ' HB1' ' A' ' 10' ' ' ALA . 1.3 m-20 55.52 179.91 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 120.73 -1.453 . . . . 4.09 110.089 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.429 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 38.1 Cg_endo -70.0 149.99 66.15 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.148 1.078 . . . . 4.1 109.666 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 C--N 1.317 -1.106 0 O-C-N 123.255 1.134 . . . . 4.82 110.511 -179.763 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.115 0.483 . . . . 3.98 110.266 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.5 t -65.53 -46.33 80.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.539 -0.726 . . . . 1.95 110.662 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.469 HD11 ' HG2' ' A' ' 57' ' ' PRO . 37.5 tp -64.77 -52.65 55.83 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.503 -0.748 . . . . 1.69 110.845 -179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 5' ' ' LEU . 11.9 p -59.56 -46.36 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.59 -0.694 . . . . 1.52 110.904 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.493 ' N ' HG13 ' A' ' 4' ' ' VAL . 85.0 mt -61.38 -40.03 92.83 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.346 -0.846 . . . . 1.92 109.404 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.492 ' O ' HG22 ' A' ' 9' ' ' VAL . 32.3 t80 -59.93 -39.85 86.93 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.045 -0.724 . . . . 3.87 109.045 178.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.832 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.6 m-20 -60.14 -39.88 87.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.408 -0.807 . . . . 1.35 109.995 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -58.94 -49.97 75.82 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.382 -0.824 . . . . 2.93 110.431 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.861 HG12 ' HB3' ' A' ' 39' ' ' LEU . 28.0 m -68.43 -38.19 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.156 -0.965 . . . . 1.07 108.626 178.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.643 ' HB1' ' HD3' ' A' ' 56' ' ' PRO . . . -59.98 -38.15 81.71 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.745 -0.597 . . . . 0.42 110.346 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.5 t -60.03 -50.38 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.678 -0.639 . . . . 0.95 110.78 -178.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.86 ' HG3' HD11 ' A' ' 39' ' ' LEU . 95.2 mm-40 -61.72 -49.24 77.26 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.202 -0.999 . . . . 1.84 109.923 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -45.04 -48.65 9.65 Favored Glycine 0 N--CA 1.506 3.333 0 N-CA-C 109.561 -1.415 . . . . 0.36 109.561 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -64.04 -35.99 82.52 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.889 -0.771 . . . . 1.12 110.742 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 11' ' ' VAL . 69.4 t -59.01 -40.05 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.414 -0.804 . . . . 0.46 109.809 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.705 HG13 HG13 ' A' ' 29' ' ' VAL . 59.1 t -59.98 -49.72 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 108.247 -1.019 . . . . 0.7 108.247 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -60.04 -45.34 93.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.696 -0.627 . . . . 3.15 110.211 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.94 -40.04 91.75 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.62 -0.675 . . . . 2.23 111.063 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 71.9 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.433 -0.792 . . . . 1.02 110.685 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.738 ' HE3' HG11 ' A' ' 29' ' ' VAL . 13.6 mmtp -63.37 -40.06 96.23 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.164 -0.68 . . . . 2.08 109.164 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.55 -26.39 68.68 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.522 -0.918 . . . . 0.81 108.522 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 76.5 mttt -86.03 8.73 19.49 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.791 -0.568 . . . . 2.11 110.629 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 48.3 mttp 59.31 20.03 8.22 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.308 -0.87 . . . . 2.28 110.545 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.58 155.9 56.97 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.59 -0.694 . . . . 0.71 110.013 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.45 160.36 50.08 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.434 1.229 . . . . 0.93 110.454 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -55.05 -26.49 37.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.498 -0.751 . . . . 2.0 110.53 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -59.95 -40.01 87.52 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.577 -0.702 . . . . 2.22 110.898 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -69.86 -43.12 72.52 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.404 -0.81 . . . . 1.46 111.023 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.738 HG11 ' HE3' ' A' ' 20' ' ' LYS . 90.4 t -68.02 -43.79 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.65 110.287 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.492 ' O ' HG12 ' A' ' 33' ' ' VAL . 85.3 m-20 -59.99 -43.52 95.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -0.754 . . . . 1.33 111.322 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.66 83.96 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.378 -0.826 . . . . 0.46 110.928 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.48 -40.14 95.11 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 120.006 -0.677 . . . . 0.39 110.686 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -68.17 -39.96 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 119.487 -0.885 . . . . 0.57 108.881 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -60.44 -40.95 92.97 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.198 -1.038 . . . . 2.82 108.198 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -62.3 -39.57 93.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.303 -0.999 . . . . 1.73 108.303 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.901 HD22 HD12 ' A' ' 39' ' ' LEU . 1.6 tm? -57.88 -40.01 79.21 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 116.033 -0.53 . . . . 1.53 109.851 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mp -56.77 -39.11 73.46 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.172 -0.955 . . . . 1.36 109.005 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.4 t -59.96 -39.65 86.34 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.87 -0.789 . . . . 1.31 108.87 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.901 HD12 HD22 ' A' ' 36' ' ' LEU . 82.7 mt -64.31 -39.8 94.63 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.935 -0.765 . . . . 0.72 108.935 179.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -59.25 -37.37 77.44 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.805 -0.559 . . . . 2.38 109.593 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.95 -39.99 87.46 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.585 -0.697 . . . . 0.69 109.799 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.53 -41.77 92.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.298 -0.876 . . . . 1.9 109.614 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -60.01 -47.24 86.63 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.653 -0.655 . . . . 2.03 111.782 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.499 ' CB ' ' HA ' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -55.67 -28.75 57.2 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.562 -0.711 . . . . 2.12 111.614 -177.037 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.468 ' N ' ' HG3' ' A' ' 44' ' ' LYS . 58.1 mm-40 -60.02 -39.93 87.58 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.256 -0.903 . . . . 2.41 110.5 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -63.31 -52.78 60.5 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.513 -0.742 . . . . 2.31 112.238 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 m -156.37 -70.92 0.11 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.011 -1.056 . . . . 2.51 112.767 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -86.63 -113.83 0.91 Allowed Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.926 -1.13 . . . . 1.86 113.2 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.499 ' HA ' ' CB ' ' A' ' 44' ' ' LYS . 32.9 mt-30 -140.98 -30.26 0.64 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.994 -0.71 . . . . 2.7 112.87 -176.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -158.02 155.74 29.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.086 -1.009 . . . . 2.37 111.425 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.445 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 51.7 p90 -65.88 150.26 48.88 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.693 -0.629 . . . . 2.77 110.454 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -62.56 148.42 90.67 Favored Pre-proline 0 N--CA 1.498 1.972 0 O-C-N 121.487 -0.758 . . . . 5.01 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -76.56 8.95 2.77 Favored 'Trans proline' 0 N--CA 1.487 1.091 0 O-C-N 123.326 1.172 . . . . 3.45 112.915 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.85 20.06 17.51 Favored Glycine 0 N--CA 1.499 2.9 0 O-C-N 120.781 -1.199 . . . . 3.07 112.052 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.404 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 1.3 m-20 57.58 174.77 0.04 OUTLIER Pre-proline 0 N--CA 1.505 2.276 0 O-C-N 120.83 -1.394 . . . . 4.09 110.76 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.643 ' HD3' ' HB1' ' A' ' 10' ' ' ALA . 39.6 Cg_endo -69.99 149.99 66.2 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 O-C-N 123.497 1.262 . . . . 4.1 111.033 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.469 ' HG2' HD11 ' A' ' 3' ' ' LEU . 42.9 Cg_endo . . . . . 0 N--CA 1.485 1.029 0 O-C-N 123.513 1.27 . . . . 4.82 110.482 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.643 ' OD1' HG23 ' A' ' 4' ' ' VAL . 12.9 p-10 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 121.252 0.548 . . . . 3.98 110.499 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m -60.0 -39.96 87.55 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 1.95 110.525 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.3 OUTLIER -60.46 -41.01 93.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.667 -0.646 . . . . 1.69 110.511 -179.023 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.643 HG23 ' OD1' ' A' ' 1' ' ' ASP . 84.5 t -59.93 -49.79 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.201 -0.937 . . . . 1.52 109.094 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.04 -38.12 81.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.639 -0.663 . . . . 1.92 109.927 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 52' ' ' LYS . 17.0 t80 -59.98 -40.0 87.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.599 -0.688 . . . . 3.87 110.127 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 11' ' ' VAL . 20.6 m120 -60.02 -39.64 86.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.499 -0.751 . . . . 1.35 110.23 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -59.97 -51.11 71.07 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.38 -0.825 . . . . 2.93 110.534 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.603 HG22 ' CD2' ' A' ' 51' ' ' TYR . 8.3 p -69.04 -42.5 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.452 -0.78 . . . . 1.07 109.785 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.416 ' N ' HG13 ' A' ' 9' ' ' VAL . . . -60.05 -47.61 85.15 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.543 -0.723 . . . . 0.42 111.269 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.633 ' O ' HG23 ' A' ' 15' ' ' VAL . 56.1 t -60.02 -48.13 89.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.61 -0.681 . . . . 0.95 110.732 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.24 -55.17 31.02 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.194 -0.941 . . . . 1.84 109.709 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.94 -55.02 2.92 Favored Glycine 0 N--CA 1.508 3.445 0 N-CA-C 111.095 -0.802 . . . . 0.36 111.095 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -63.87 -38.46 91.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.75 -0.853 . . . . 1.12 111.377 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 11' ' ' VAL . 72.6 t -59.46 -40.05 80.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.459 -0.776 . . . . 0.46 109.683 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.538 HG22 ' HB3' ' A' ' 32' ' ' ALA . 54.5 t -59.96 -50.05 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.271 -0.893 . . . . 0.7 108.67 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.6 ttp85 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.604 -0.685 . . . . 3.15 109.967 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -60.11 -45.14 93.96 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.626 -0.671 . . . . 2.23 110.442 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.95 -40.09 87.8 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.401 0.62 . . . . 1.02 110.088 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.694 ' HD2' HG21 ' A' ' 29' ' ' VAL . 2.4 tptm -63.33 -40.15 96.53 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.018 -0.734 . . . . 2.08 109.018 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.44 -27.81 68.78 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.214 -1.032 . . . . 0.81 108.214 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 59.5 mtpt -86.37 9.11 18.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.765 -0.585 . . . . 2.11 110.904 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 56.1 mttm 59.32 22.11 10.44 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.28 -0.887 . . . . 2.28 110.9 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.27 161.09 10.6 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.603 -0.686 . . . . 0.71 110.397 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.12 158.3 52.42 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.462 1.243 . . . . 0.93 110.143 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -55.48 -28.06 52.21 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.501 -0.75 . . . . 2.0 110.448 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -59.33 -41.63 89.56 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.624 -0.672 . . . . 2.22 110.352 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -70.5 -42.78 70.89 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.489 -0.757 . . . . 1.46 110.37 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.694 HG21 ' HD2' ' A' ' 20' ' ' LYS . 65.7 t -68.86 -49.39 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.726 -0.609 . . . . 0.65 110.522 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.416 ' O ' HG12 ' A' ' 33' ' ' VAL . 99.6 m-20 -60.08 -43.23 95.64 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.433 -0.792 . . . . 1.33 111.491 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -49.99 75.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.308 -0.87 . . . . 0.46 110.707 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.538 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -65.32 -41.57 93.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.188 -0.605 . . . . 0.39 110.548 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.416 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.09 -38.44 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 108.262 -1.014 . . . . 0.57 108.262 179.357 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -60.82 -41.21 95.28 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.687 -0.857 . . . . 2.82 108.687 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.1 tp60 -64.69 -41.93 95.68 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.221 -1.029 . . . . 1.73 108.221 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.601 HD13 ' C ' ' A' ' 36' ' ' LEU . 3.1 tm? -60.01 -41.18 91.59 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 116.065 -0.516 . . . . 1.53 110.093 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.9 mt -59.6 -40.01 86.06 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.409 -0.807 . . . . 1.36 109.946 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.6 m -60.08 -39.99 88.01 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.593 -0.692 . . . . 1.31 109.255 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.1 -46.5 80.82 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.453 -0.943 . . . . 0.72 108.453 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -60.04 -40.98 91.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.926 -0.484 . . . . 2.38 110.348 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.05 -40.44 97.7 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.527 -0.733 . . . . 0.69 110.285 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -66.76 -39.98 88.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.52 -0.737 . . . . 1.9 110.037 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -43.62 95.14 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.542 -0.724 . . . . 2.03 109.952 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -63.71 -27.6 69.32 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.668 -0.645 . . . . 2.12 111.81 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -39.57 69.3 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.151 -0.968 . . . . 2.41 110.911 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -62.24 -58.41 7.85 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.568 -0.708 . . . . 2.31 110.276 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.475 HG23 ' HG3' ' A' ' 49' ' ' GLN . 4.4 t -161.43 29.57 0.13 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.461 -0.774 . . . . 2.51 110.377 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.46 47.64 27.37 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.526 -1.03 . . . . 1.86 110.526 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.475 ' HG3' HG23 ' A' ' 47' ' ' THR . 99.5 mt-30 -85.71 -11.43 53.71 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.356 -1.085 . . . . 2.7 111.163 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 35.97 -157.76 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.689 0 N-CA-C 112.519 0.562 . . . . 2.37 112.519 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.603 ' CD2' HG22 ' A' ' 9' ' ' VAL . 33.4 t80 -67.59 116.15 7.99 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.275 -0.891 . . . . 2.77 109.919 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.482 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 10.2 mmmt -69.95 135.77 87.46 Favored Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.482 -0.761 . . . . 5.01 109.58 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -81.34 -166.99 0.44 Allowed 'Trans proline' 0 C--N 1.318 -1.061 0 O-C-N 123.095 1.05 . . . . 3.45 111.212 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 75.63 5.54 78.83 Favored Glycine 0 N--CA 1.495 2.604 0 O-C-N 121.681 -0.637 . . . . 3.07 112.029 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.419 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 72.7 m-80 55.46 165.55 0.06 OUTLIER Pre-proline 0 N--CA 1.506 2.363 0 CA-C-N 118.693 1.247 . . . . 4.09 111.164 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 55' ' ' ASN . 37.9 Cg_endo -70.02 150.01 66.02 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 O-C-N 122.946 0.972 . . . . 4.1 111.182 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.32 -0.961 0 O-C-N 123.522 1.275 . . . . 4.82 110.501 179.908 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.564 ' O ' HG22 ' A' ' 4' ' ' VAL . 94.5 m-20 . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 121.209 0.528 . . . . 3.98 110.69 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -69.22 -10.39 57.54 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.597 -0.69 . . . . 1.95 111.108 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.609 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.5 OUTLIER -59.95 -42.9 95.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.231 -0.918 . . . . 1.69 111.197 -178.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.566 HG23 HD12 ' A' ' 5' ' ' LEU . 29.6 m -54.93 -43.42 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.212 -0.93 . . . . 1.52 110.622 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.566 HD12 HG23 ' A' ' 4' ' ' VAL . 2.3 mp -60.9 -40.1 91.81 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.453 -0.779 . . . . 1.92 109.69 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.496 ' O ' HG22 ' A' ' 9' ' ' VAL . 5.4 t80 -59.66 -39.37 84.2 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.542 0.687 . . . . 3.87 110.028 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.746 ' O ' HG23 ' A' ' 11' ' ' VAL . 24.6 m120 -59.97 -39.34 85.32 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.756 . . . . 1.35 110.048 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.4 mmm-85 -60.01 -49.91 75.8 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.768 . . . . 2.93 110.519 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.763 HG12 ' HB3' ' A' ' 39' ' ' LEU . 32.9 m -67.19 -40.07 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 C-N-CA 119.235 -0.986 . . . . 1.07 108.417 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.96 93.2 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.756 -0.59 . . . . 0.42 111.437 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 7' ' ' ASN . 39.6 t -59.99 -52.16 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.481 -0.762 . . . . 0.95 111.411 -178.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.492 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 96.5 mm-40 -60.17 -47.28 86.6 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.242 -0.911 . . . . 1.84 110.477 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.516 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -41.54 -52.59 4.47 Favored Glycine 0 N--CA 1.509 3.531 0 N-CA-C 109.936 -1.266 . . . . 0.36 109.936 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -65.97 -37.04 84.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 122.122 -0.634 . . . . 1.12 111.256 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 11' ' ' VAL . 93.3 t -60.02 -40.31 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.315 -0.866 . . . . 0.46 109.689 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.04 -49.91 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 108.878 -0.786 . . . . 0.7 108.878 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.57 -43.0 97.77 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.612 -0.68 . . . . 3.15 110.784 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -61.63 -44.24 97.36 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.408 -0.807 . . . . 2.23 111.084 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 85.9 mt -60.04 -39.97 87.76 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.427 0.632 . . . . 1.02 110.464 -179.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -65.98 -39.99 90.83 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.253 0.549 . . . . 2.08 109.571 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.55 66.85 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 108.918 -0.771 . . . . 0.81 108.918 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' HE2' ' HA ' ' A' ' 19' ' ' LEU . 9.1 mtmt -86.69 10.14 16.64 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.614 -0.835 . . . . 2.11 111.001 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 58.85 21.99 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.228 -0.92 . . . . 2.28 110.812 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.498 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -58.68 160.33 10.63 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.516 -0.74 . . . . 0.71 109.944 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.38 167.77 26.37 Favored 'Trans proline' 0 C--N 1.316 -1.168 0 O-C-N 123.359 1.189 . . . . 0.93 109.838 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -53.92 -22.65 10.6 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.544 -0.722 . . . . 2.0 110.364 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -55.74 -45.71 77.94 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.54 -0.725 . . . . 2.22 110.27 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.498 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 98.2 m-20 -72.22 -40.9 67.46 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.546 -0.721 . . . . 1.46 111.113 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 55.9 t -68.29 -47.61 77.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.488 -0.758 . . . . 0.65 110.214 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.8 m-20 -59.94 -46.43 89.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.715 . . . . 1.33 110.951 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.47 -49.96 73.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.406 -0.809 . . . . 0.46 110.649 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.58 -42.47 95.6 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.042 -0.663 . . . . 0.39 110.358 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -67.64 -37.84 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.465 -0.939 . . . . 0.57 108.465 179.445 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 37' ' ' LEU . 85.5 tttt -59.97 -37.87 80.86 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.902 0.858 . . . . 2.82 108.881 178.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -60.0 -41.56 92.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.936 -0.477 . . . . 1.73 109.761 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.516 HD11 ' HA2' ' A' ' 13' ' ' GLY . 22.6 mt -59.15 -39.97 84.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.837 -0.539 . . . . 1.53 110.771 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 34' ' ' LYS . 84.4 mt -58.32 -40.58 82.45 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.519 -0.738 . . . . 1.36 110.032 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.5 m -62.35 -39.99 94.94 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.744 -0.783 . . . . 1.31 109.644 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HG12 ' A' ' 9' ' ' VAL . 25.6 mt -66.9 -51.49 54.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.644 . . . . 0.72 109.379 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -60.72 -39.96 90.54 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.753 -0.592 . . . . 2.38 109.735 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.1 -42.51 94.82 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.885 -0.509 . . . . 0.69 111.042 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -70.03 -43.15 71.88 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.324 -0.86 . . . . 1.9 110.749 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.429 ' CD1' ' CB ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -62.02 -49.02 77.69 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 2.03 112.352 -179.335 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -59.7 -23.16 62.9 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.225 -0.922 . . . . 2.12 111.429 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -60.04 -39.99 87.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.418 -0.801 . . . . 2.41 110.807 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.99 -60.06 2.79 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.374 -0.93 . . . . 2.31 110.561 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.545 HG22 ' O ' ' A' ' 47' ' ' THR . 32.7 m -160.18 45.29 0.22 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.148 -0.97 . . . . 2.51 111.868 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.38 42.08 96.17 Favored Glycine 0 N--CA 1.5 2.911 0 N-CA-C 109.073 -1.611 . . . . 1.86 109.073 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.429 ' CB ' ' CD1' ' A' ' 43' ' ' TYR . 93.8 mt-30 -96.76 28.35 3.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.703 -0.88 . . . . 2.7 110.939 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -52.41 178.44 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.712 -0.617 . . . . 2.37 110.849 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -55.13 102.94 0.08 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.541 -0.724 . . . . 2.77 111.519 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -70.38 156.04 92.5 Favored Pre-proline 0 N--CA 1.494 1.726 0 N-CA-C 109.158 -0.682 . . . . 5.01 109.158 178.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -76.82 -175.39 2.6 Favored 'Trans proline' 0 C--N 1.314 -1.246 0 O-C-N 123.24 1.126 . . . . 3.45 111.446 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 73.95 4.43 67.16 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 111.39 -0.684 . . . . 3.07 111.39 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.0 174.31 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.19 0 O-C-N 120.963 -1.316 . . . . 4.09 110.808 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.0 150.02 66.18 Favored 'Trans proline' 0 N--CA 1.487 1.106 0 O-C-N 123.387 1.204 . . . . 4.1 110.326 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 C--N 1.316 -1.141 0 O-C-N 123.431 1.227 . . . . 4.82 110.472 -179.747 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 121.34 0.59 . . . . 3.98 110.236 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 5' ' ' LEU . 50.6 m -61.31 -40.0 92.58 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.614 -0.679 . . . . 1.95 110.543 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.13 -41.02 97.85 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.477 -0.764 . . . . 1.69 109.872 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.4 t -59.82 -41.06 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.88 -0.513 . . . . 1.52 110.421 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 2' ' ' SER . 57.6 mt -60.01 -43.5 95.19 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.251 -0.906 . . . . 1.92 109.843 -179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.02 -39.11 84.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.611 -0.68 . . . . 3.87 109.75 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.734 ' O ' HG13 ' A' ' 11' ' ' VAL . 30.8 m120 -60.99 -40.64 94.27 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 1.35 110.719 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.7 -50.39 73.67 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.298 -0.876 . . . . 2.93 110.956 -179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.763 HG12 ' HB3' ' A' ' 39' ' ' LEU . 17.5 m -70.14 -40.57 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 1.07 108.472 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.438 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.84 -50.54 73.01 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 112.89 0.7 . . . . 0.42 112.89 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.734 HG13 ' O ' ' A' ' 7' ' ' ASN . 32.8 m -60.2 -45.2 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.169 -0.957 . . . . 0.95 111.827 -177.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.53 ' HG3' HD11 ' A' ' 39' ' ' LEU . 29.5 mm100 -60.15 -50.39 73.88 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.049 -1.032 . . . . 1.84 110.372 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.606 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -45.79 -41.69 10.34 Favored Glycine 0 N--CA 1.507 3.372 0 N-CA-C 109.302 -1.519 . . . . 0.36 109.302 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -66.16 -37.44 85.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 122.097 -0.649 . . . . 1.12 110.908 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.1 t -60.01 -40.87 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.53 -0.731 . . . . 0.46 110.012 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.453 HG22 ' CB ' ' A' ' 32' ' ' ALA . 61.5 t -60.69 -46.36 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.281 -0.887 . . . . 0.7 109.045 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -59.95 -40.06 87.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.571 -0.705 . . . . 3.15 110.654 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -59.99 -42.82 95.06 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.546 -0.721 . . . . 2.23 110.059 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.03 -40.03 87.92 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.752 -0.592 . . . . 1.02 110.577 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.582 ' HE2' HG11 ' A' ' 29' ' ' VAL . 46.8 mmtt -60.63 -44.19 96.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.33 -0.856 . . . . 2.08 109.093 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.26 68.55 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.312 -0.996 . . . . 0.81 108.312 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -85.48 8.21 19.95 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.761 -0.587 . . . . 2.11 110.764 179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt 58.46 21.61 8.67 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.242 -0.911 . . . . 2.28 110.755 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.61 148.68 80.91 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.633 -0.667 . . . . 0.71 110.183 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -70.36 168.2 23.03 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.418 1.22 . . . . 0.93 110.898 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.3 mmmt -55.92 -30.74 62.1 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.811 -0.555 . . . . 2.0 110.84 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -59.09 -40.02 83.98 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.498 -0.751 . . . . 2.22 110.532 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -71.48 -44.07 65.43 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.433 -0.792 . . . . 1.46 110.478 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.582 HG11 ' HE2' ' A' ' 20' ' ' LYS . 94.2 t -69.08 -40.58 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.69 -0.631 . . . . 0.65 110.328 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.454 ' O ' HG12 ' A' ' 33' ' ' VAL . 87.3 m-20 -59.27 -47.84 83.86 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.334 -0.853 . . . . 1.33 111.084 -179.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.71 -49.67 75.53 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.114 -0.991 . . . . 0.46 110.651 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.453 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -66.21 -40.14 90.13 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.691 -0.63 . . . . 0.39 110.879 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.454 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.19 -38.37 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 108.516 -0.92 . . . . 0.57 108.516 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 30' ' ' ASP . 64.0 mmtt -60.49 -40.0 89.74 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.527 -0.733 . . . . 2.82 109.197 177.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -61.23 -53.07 61.51 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.704 -0.623 . . . . 1.73 109.666 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.606 HD22 ' HA2' ' A' ' 13' ' ' GLY . 0.1 OUTLIER -60.16 -40.09 88.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.657 -0.652 . . . . 1.53 109.644 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.06 -39.97 87.84 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.391 -0.818 . . . . 1.36 109.583 179.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -59.99 -39.47 85.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 1.31 109.391 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HG12 ' A' ' 9' ' ' VAL . 93.6 mt -59.96 -55.21 36.86 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.618 -0.676 . . . . 0.72 110.581 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.7 pttp -65.77 -29.96 70.54 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.175 -0.953 . . . . 2.38 109.428 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.59 92.52 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.295 -0.562 . . . . 0.69 109.645 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -63.83 -44.64 92.63 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.233 -1.025 . . . . 1.9 108.233 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -60.42 -41.65 94.4 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.623 0.725 . . . . 2.03 109.836 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.98 -39.75 86.79 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.829 -0.545 . . . . 2.12 111.237 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -55.68 -40.01 71.73 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.347 -0.846 . . . . 2.41 111.187 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -63.71 -85.01 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.234 -0.916 . . . . 2.31 110.623 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.4 t -159.97 51.75 0.33 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.014 -1.054 . . . . 2.51 111.705 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.28 41.22 69.11 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.616 -0.994 . . . . 1.86 110.616 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -95.56 23.18 6.27 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.47 -1.017 . . . . 2.7 111.048 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.9 141.18 55.94 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.592 0.711 . . . . 2.37 110.236 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.49 ' CD2' HG21 ' A' ' 9' ' ' VAL . 55.6 p90 -56.29 149.11 17.05 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.502 0.668 . . . . 2.77 111.452 -178.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.6 mttm -68.11 158.79 82.97 Favored Pre-proline 0 N--CA 1.496 1.875 0 O-C-N 121.757 -0.59 . . . . 5.01 110.481 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.47 -17.63 48.95 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.327 1.172 . . . . 3.45 112.139 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.37 54.64 Favored Glycine 0 N--CA 1.497 2.754 0 C-N-CA 119.603 -1.284 . . . . 3.07 111.93 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.433 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 3.1 m-20 55.63 178.69 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.405 0 O-C-N 120.749 -1.442 . . . . 4.09 109.879 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' A' ' 55' ' ' ASN . 37.3 Cg_endo -69.94 149.98 66.49 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 123.036 1.019 . . . . 4.1 110.295 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.318 -1.032 0 O-C-N 123.487 1.256 . . . . 4.82 110.649 -179.386 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.434 ' O ' HG12 ' A' ' 4' ' ' VAL . 49.8 t0 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.055 0.455 . . . . 3.98 110.326 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -69.9 -12.87 61.94 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.588 -0.695 . . . . 1.95 111.039 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.579 HD11 ' HG2' ' A' ' 57' ' ' PRO . 7.3 tp -60.63 -39.66 89.06 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.205 -0.934 . . . . 1.69 110.556 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.461 HG13 ' N ' ' A' ' 5' ' ' LEU . 7.8 p -55.27 -43.48 71.15 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.417 -0.802 . . . . 1.52 110.48 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.461 ' N ' HG13 ' A' ' 4' ' ' VAL . 81.1 mt -60.2 -40.0 88.56 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.637 -0.664 . . . . 1.92 109.428 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.424 ' CD1' ' HA ' ' A' ' 56' ' ' PRO . 0.3 OUTLIER -57.03 -47.58 80.57 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-O 121.488 0.661 . . . . 3.87 109.599 179.346 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.572 ' O ' HG13 ' A' ' 11' ' ' VAL . 78.3 m-20 -62.43 -40.07 95.36 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.622 -0.674 . . . . 1.35 110.799 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.74 ' HG2' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -59.97 -49.89 75.88 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.408 -0.808 . . . . 2.93 110.647 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.79 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.03 -40.0 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 1.07 109.23 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.733 ' HB1' ' HD3' ' A' ' 56' ' ' PRO . . . -59.97 -49.74 76.48 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.79 0.663 . . . . 0.42 112.79 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.825 ' O ' HG23 ' A' ' 15' ' ' VAL . 34.2 m -59.88 -45.38 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.172 -0.955 . . . . 0.95 111.037 -177.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.486 ' HG3' HD11 ' A' ' 39' ' ' LEU . 93.7 mm-40 -60.93 -49.46 77.37 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.106 -0.996 . . . . 1.84 109.673 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.53 -58.85 2.04 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.408 -1.077 . . . . 0.36 110.408 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -63.64 -36.29 83.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.835 -0.803 . . . . 1.12 111.028 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.825 HG23 ' O ' ' A' ' 11' ' ' VAL . 90.1 t -60.01 -40.48 83.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.332 -0.855 . . . . 0.46 109.579 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 32' ' ' ALA . 66.5 t -60.2 -50.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.394 -0.816 . . . . 0.7 109.235 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -62.56 -42.95 99.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.65 -0.657 . . . . 3.15 111.244 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.96 -44.44 94.43 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.557 -0.714 . . . . 2.23 110.722 -178.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.4 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.822 -0.549 . . . . 1.02 110.904 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.667 ' HD3' HG21 ' A' ' 29' ' ' VAL . 12.2 tptt -65.99 -40.05 90.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.646 -0.659 . . . . 2.08 109.383 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.58 -26.99 67.36 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.841 -0.8 . . . . 0.81 108.841 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 98.3 mttt -86.17 9.13 18.39 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.058 -0.657 . . . . 2.11 110.509 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 84.6 mttt 58.97 19.94 7.68 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.377 -0.827 . . . . 2.28 110.968 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.596 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -58.94 167.58 1.88 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.57 -0.706 . . . . 0.71 109.734 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.489 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 51.4 Cg_endo -73.61 163.99 36.03 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 O-C-N 123.355 1.187 . . . . 0.93 110.107 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mttp -54.59 -23.55 17.38 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.473 -0.767 . . . . 2.0 109.594 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -56.71 -40.57 75.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.704 -0.623 . . . . 2.22 110.383 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.596 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 86.6 m-20 -73.22 -42.27 62.82 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.545 -0.722 . . . . 1.46 111.023 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.667 HG21 ' HD3' ' A' ' 20' ' ' LYS . 62.5 t -69.94 -54.04 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.538 -0.726 . . . . 0.65 110.963 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -60.21 -41.02 92.13 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.43 -0.794 . . . . 1.33 112.101 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.95 75.41 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.241 -0.912 . . . . 0.46 110.9 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.569 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -66.43 -41.41 89.23 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 119.938 -0.705 . . . . 0.39 110.192 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.403 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -66.63 -39.03 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.044 -1.095 . . . . 0.57 108.044 178.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -60.26 -43.74 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.179 -1.045 . . . . 2.82 108.179 177.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -65.81 -45.81 80.96 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.562 -0.903 . . . . 1.73 108.562 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.403 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 7.9 tp -59.69 -39.95 86.28 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 109.749 -0.463 . . . . 1.53 109.749 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -58.9 -39.99 83.13 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.369 -0.832 . . . . 1.36 109.512 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -61.53 -41.53 97.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 1.31 109.137 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.79 ' HB3' HG12 ' A' ' 9' ' ' VAL . 71.6 mt -62.57 -49.93 73.33 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.818 -0.808 . . . . 0.72 108.818 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -60.06 -40.02 88.03 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.56 0.695 . . . . 2.38 109.231 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.7 -44.27 96.78 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.951 -0.468 . . . . 0.69 110.649 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.01 -47.17 86.95 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.248 -0.907 . . . . 1.9 109.594 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -42.74 94.79 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.918 0.866 . . . . 2.03 109.466 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -60.62 -40.03 90.4 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.942 -0.572 . . . . 2.12 112.137 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.44 -39.95 85.22 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.288 -0.882 . . . . 2.41 111.595 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -61.53 -51.26 69.32 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.291 -0.881 . . . . 2.31 111.462 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 47' ' ' THR . 82.4 m -157.91 16.13 0.23 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.27 -0.894 . . . . 2.51 112.093 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.03 37.74 73.67 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.074 -1.21 . . . . 1.86 110.074 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.47 ' O ' ' O ' ' A' ' 50' ' ' GLU . 97.9 mt-30 -84.73 -24.06 29.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.487 -1.008 . . . . 2.7 110.714 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 49' ' ' GLN . 13.3 pt-20 40.91 175.18 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.628 0 CA-C-O 122.57 1.176 . . . . 2.37 113.924 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.425 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.6 t80 -69.45 124.45 23.91 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.149 -0.969 . . . . 2.77 110.982 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -70.84 145.85 92.49 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.527 -0.733 . . . . 5.01 109.111 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -75.82 -6.91 18.0 Favored 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.257 1.135 . . . . 3.45 112.996 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.14 32.54 4.06 Favored Glycine 0 N--CA 1.502 3.078 0 C-N-CA 119.559 -1.305 . . . . 3.07 112.767 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.426 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.3 OUTLIER 54.46 179.82 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.529 0 CA-C-N 119.176 1.488 . . . . 4.09 110.288 179.219 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.733 ' HD3' ' HB1' ' A' ' 10' ' ' ALA . 37.8 Cg_endo -69.93 149.98 66.53 Favored 'Trans proline' 0 N--CA 1.488 1.17 0 O-C-N 123.151 1.079 . . . . 4.1 111.063 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.579 ' HG2' HD11 ' A' ' 3' ' ' LEU . 48.1 Cg_endo . . . . . 0 C--N 1.321 -0.901 0 O-C-N 123.597 1.314 . . . . 4.82 110.684 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.675 ' O ' HG22 ' A' ' 4' ' ' VAL . 6.1 t70 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 120.957 0.408 . . . . 3.98 110.054 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.2 m -68.33 -12.59 61.31 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.481 -0.762 . . . . 1.95 110.996 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.08 -35.78 79.69 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.121 -0.987 . . . . 1.69 110.736 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 1' ' ' ASP . 35.7 m -55.62 -42.07 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.349 -0.845 . . . . 1.52 110.385 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.468 ' N ' HG23 ' A' ' 4' ' ' VAL . 68.6 mt -60.47 -41.43 94.18 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.499 -0.751 . . . . 1.92 109.603 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -42.8 78.51 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.8 -0.563 . . . . 3.87 110.129 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.612 ' O ' HG23 ' A' ' 11' ' ' VAL . 28.9 m120 -59.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.574 -0.704 . . . . 1.35 111.509 -179.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -60.08 -56.32 23.05 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.178 -0.951 . . . . 2.93 110.378 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.607 HG21 ' CD1' ' A' ' 51' ' ' TYR . 8.6 p -69.32 -38.03 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.401 -0.812 . . . . 1.07 110.128 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.549 ' HB1' ' HB2' ' A' ' 55' ' ' ASN . . . -59.98 -46.43 89.49 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.57 -0.706 . . . . 0.42 111.557 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 7' ' ' ASN . 63.6 t -59.98 -47.96 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.548 -0.72 . . . . 0.95 110.383 -178.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.487 ' O ' HG12 ' A' ' 15' ' ' VAL . 6.7 tp-100 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.359 -0.838 . . . . 1.84 109.97 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -42.6 -48.53 5.93 Favored Glycine 0 N--CA 1.508 3.48 0 N-CA-C 110.181 -1.168 . . . . 0.36 110.181 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -62.89 -37.36 86.63 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.999 -0.707 . . . . 1.12 111.464 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.487 HG12 ' O ' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -59.21 -39.24 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.156 -0.965 . . . . 0.46 109.702 -179.023 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.48 HG22 ' CB ' ' A' ' 32' ' ' ALA . 54.5 t -59.97 -44.8 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 N-CA-C 108.924 -0.769 . . . . 0.7 108.924 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -59.99 -41.6 92.38 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 3.15 109.868 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.04 -40.1 95.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 2.23 111.18 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.08 -40.0 92.06 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.411 -0.806 . . . . 1.02 110.86 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.504 ' CD ' HG21 ' A' ' 29' ' ' VAL . 12.4 tptm -65.69 -42.31 91.35 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.504 -0.747 . . . . 2.08 109.028 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.82 64.38 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.767 -0.827 . . . . 0.81 108.767 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp -85.95 8.62 19.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.683 -0.636 . . . . 2.11 110.721 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 59.3 20.09 8.27 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.272 -0.892 . . . . 2.28 111.144 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.99 161.76 8.38 Favored Pre-proline 0 N--CA 1.498 1.945 0 O-C-N 121.506 -0.746 . . . . 0.71 110.137 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.39 165.26 32.26 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.485 1.255 . . . . 0.93 110.912 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -57.0 -31.7 65.36 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.672 -0.642 . . . . 2.0 110.673 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.64 -40.02 82.23 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.571 -0.705 . . . . 2.22 110.507 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -70.13 -41.45 73.89 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.637 -0.664 . . . . 1.46 110.77 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.504 HG21 ' CD ' ' A' ' 20' ' ' LYS . 99.8 t -66.93 -51.27 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.566 -0.709 . . . . 0.65 109.751 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.3 m-20 -60.02 -45.6 92.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.758 -0.589 . . . . 1.33 110.758 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.46 75.39 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.311 -0.868 . . . . 0.46 110.36 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.48 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -63.34 -43.5 97.56 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.139 -0.624 . . . . 0.39 110.628 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.656 ' HA ' HD23 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -65.63 -37.34 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 119.456 -0.898 . . . . 0.57 108.839 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 tppt? -59.97 -39.2 84.83 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.778 0.799 . . . . 2.82 109.207 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -60.0 -45.67 91.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.924 -0.485 . . . . 1.73 110.703 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.656 HD23 ' HA ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -60.06 -35.29 74.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.298 -0.876 . . . . 1.53 110.344 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.515 HD12 ' HG ' ' A' ' 36' ' ' LEU . 2.2 mp -58.66 -39.77 81.59 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.234 -0.916 . . . . 1.36 109.643 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.451 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 24.6 p -60.01 -40.01 87.81 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 109.095 -0.705 . . . . 1.31 109.095 179.075 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.5 mt -65.16 -47.66 76.27 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.986 -0.746 . . . . 0.72 108.986 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -61.39 -31.57 71.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.148 -0.686 . . . . 2.38 109.148 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 38' ' ' SER . . . -59.84 -41.5 91.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.698 -0.626 . . . . 0.69 109.419 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.87 -48.64 79.6 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 119.79 -0.764 . . . . 1.9 109.208 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.458 ' CE2' ' CB ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -61.06 -38.51 86.46 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.917 0.865 . . . . 2.03 108.772 178.076 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -60.55 -27.31 67.56 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 116.085 -0.507 . . . . 2.12 111.308 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -55.02 -39.85 69.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.252 -0.905 . . . . 2.41 110.929 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -64.63 -59.85 3.8 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.549 -0.861 . . . . 2.31 110.356 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -165.55 28.89 0.05 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.296 -0.878 . . . . 2.51 111.637 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.98 73.38 0.69 Allowed Glycine 0 N--CA 1.497 2.765 0 N-CA-C 108.994 -1.643 . . . . 1.86 108.994 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 28.9 mm100 -87.02 -16.42 35.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.634 -0.921 . . . . 2.7 111.984 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 30.26 100.22 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 113.267 0.84 . . . . 2.37 113.267 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.607 ' CD1' HG21 ' A' ' 9' ' ' VAL . 32.6 p90 -57.09 140.56 48.92 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.125 -0.984 . . . . 2.77 111.492 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -64.67 164.28 21.67 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.657 -0.652 . . . . 5.01 109.709 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.63 -30.01 18.87 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.397 1.209 . . . . 3.45 111.294 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.2 29.54 5.14 Favored Glycine 0 N--CA 1.496 2.683 0 C-N-CA 119.724 -1.226 . . . . 3.07 111.892 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.549 ' HB2' ' HB1' ' A' ' 10' ' ' ALA . 0.9 OUTLIER 52.01 -178.15 0.02 OUTLIER Pre-proline 0 N--CA 1.503 2.19 0 CA-C-N 118.786 1.293 . . . . 4.09 110.484 179.524 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.406 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 37.8 Cg_endo -69.99 149.97 66.18 Favored 'Trans proline' 0 N--CA 1.49 1.302 0 O-C-N 122.883 0.938 . . . . 4.1 111.44 -179.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo . . . . . 0 C--N 1.318 -1.061 0 O-C-N 123.308 1.162 . . . . 4.82 110.603 -179.212 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.194 0.521 . . . . 3.98 110.276 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.5 p -68.5 -23.06 64.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.615 -0.678 . . . . 1.95 110.306 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.58 -42.87 99.48 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.254 -0.904 . . . . 1.69 109.363 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.5 t -55.42 -44.07 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 N-CA-C 109.348 -0.612 . . . . 1.52 109.348 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.39 -40.5 94.56 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.782 -0.574 . . . . 1.92 110.662 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.458 ' O ' HG22 ' A' ' 9' ' ' VAL . 11.1 m-85 -59.75 -40.05 86.82 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.498 -0.751 . . . . 3.87 110.463 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.868 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 m120 -60.16 -40.21 89.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.574 -0.704 . . . . 1.35 110.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.92 -49.76 76.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.485 -0.759 . . . . 2.93 111.232 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.525 ' HA ' HD13 ' A' ' 39' ' ' LEU . 26.9 m -65.21 -39.95 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 1.07 109.61 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.57 -38.34 84.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.465 -0.772 . . . . 0.42 110.736 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.868 HG23 ' O ' ' A' ' 7' ' ' ASN . 72.7 t -60.1 -50.13 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.642 -0.661 . . . . 0.95 110.7 -177.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.465 ' HG2' HD11 ' A' ' 39' ' ' LEU . 6.7 mp0 -61.87 -50.93 70.25 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.011 -1.056 . . . . 1.84 109.818 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.58 -49.93 4.84 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.974 -1.25 . . . . 0.36 109.974 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.39 -36.8 85.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 122.07 -0.665 . . . . 1.12 111.342 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 68.3 t -59.66 -41.07 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.188 -0.945 . . . . 0.46 109.726 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -59.94 -48.09 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.265 -0.897 . . . . 0.7 108.944 178.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -60.05 -47.6 85.17 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.656 -0.652 . . . . 3.15 110.337 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -62.47 -42.55 99.56 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.589 -0.694 . . . . 2.23 111.192 -178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.7 -40.25 96.32 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.317 -0.865 . . . . 1.02 111.039 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.502 ' HD2' HG21 ' A' ' 29' ' ' VAL . 17.0 tptm -66.33 -40.23 89.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.637 -0.665 . . . . 2.08 109.882 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -28.12 68.12 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.474 -0.936 . . . . 0.81 108.474 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 62.7 mtpt -84.08 8.77 14.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.854 -0.529 . . . . 2.11 111.002 178.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 95.3 mttt 57.61 27.57 14.4 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 2.28 111.094 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.419 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -57.18 163.43 3.19 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.739 -0.601 . . . . 0.71 110.706 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.419 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 43.7 Cg_endo -68.9 166.17 27.37 Favored 'Trans proline' 0 C--N 1.315 -1.217 0 O-C-N 123.592 1.312 . . . . 0.93 110.081 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -58.52 -34.33 70.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.671 -0.643 . . . . 2.0 110.811 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.65 -39.79 74.31 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.583 -0.698 . . . . 2.22 110.419 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.86 -46.57 57.47 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.658 -0.651 . . . . 1.46 111.326 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.502 HG21 ' HD2' ' A' ' 20' ' ' LYS . 94.3 t -69.41 -50.05 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.251 -0.906 . . . . 0.65 111.134 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' O ' HG12 ' A' ' 33' ' ' VAL . 59.3 m-20 -59.91 -49.11 78.98 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.454 -0.779 . . . . 1.33 111.277 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.0 -46.21 91.68 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.506 -0.747 . . . . 0.46 110.766 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.31 80.5 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 119.867 -0.733 . . . . 0.39 110.159 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -64.97 -39.63 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.19 -1.041 . . . . 0.57 108.19 179.407 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.441 ' HA ' HD12 ' A' ' 37' ' ' LEU . 34.7 tttp -61.52 -41.64 97.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.105 -1.072 . . . . 2.82 108.105 177.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -65.84 -42.84 90.0 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.539 -0.912 . . . . 1.73 108.539 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.602 HD13 ' C ' ' A' ' 36' ' ' LEU . 3.3 tm? -60.04 -40.81 90.66 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 115.952 -0.567 . . . . 1.53 109.719 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 34' ' ' LYS . 74.4 mt -59.99 -39.71 86.66 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.611 -0.68 . . . . 1.36 109.754 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.6 t -59.87 -36.62 77.27 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 1.31 109.521 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 9' ' ' VAL . 82.3 mt -60.05 -51.09 71.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.611 -0.681 . . . . 0.72 110.117 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -60.98 -39.33 89.22 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.527 -0.733 . . . . 2.38 109.627 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.55 91.87 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.766 -0.584 . . . . 0.69 110.487 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -60.79 -49.45 77.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.306 -0.871 . . . . 1.9 109.591 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -61.37 -38.26 86.36 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.688 -0.632 . . . . 2.03 110.092 178.749 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -59.89 -37.78 80.36 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.72 -0.613 . . . . 2.12 110.771 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -57.98 -39.46 78.23 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.423 -0.798 . . . . 2.41 111.25 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -61.21 -54.33 45.57 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.12 -0.988 . . . . 2.31 111.229 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 47' ' ' THR . 41.4 m -156.61 16.47 0.31 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.256 -0.902 . . . . 2.51 111.433 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.74 29.97 68.89 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.48 -1.048 . . . . 1.86 110.48 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' GLU . 91.5 mm-40 -83.95 -23.83 30.94 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.32 -1.106 . . . . 2.7 110.866 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.432 ' HA ' ' HB3' ' A' ' 43' ' ' TYR . 8.5 pt-20 40.64 -175.1 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 121.805 0.812 . . . . 2.37 112.855 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.1 t80 -66.46 101.96 0.82 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.152 -0.968 . . . . 2.77 110.595 -178.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -69.98 160.04 81.9 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.507 -0.746 . . . . 5.01 109.176 178.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.4 -60.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.178 1.094 . . . . 3.45 111.126 -179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.1 1.2 70.46 Favored Glycine 0 N--CA 1.489 2.223 0 C-N-CA 119.541 -1.314 . . . . 3.07 110.32 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.424 ' N ' ' CD ' ' A' ' 56' ' ' PRO . 0.8 OUTLIER 48.85 49.31 7.3 Favored Pre-proline 0 N--CA 1.499 2.004 0 O-C-N 121.142 -1.21 . . . . 4.09 111.426 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 55' ' ' ASN . 38.1 Cg_endo -69.97 150.06 66.4 Favored 'Trans proline' 0 N--CA 1.486 1.06 0 O-C-N 123.223 1.117 . . . . 4.1 110.451 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo . . . . . 0 C--N 1.317 -1.099 0 O-C-N 123.305 1.161 . . . . 4.82 110.32 179.907 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.017 0.437 . . . . 3.98 110.179 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.406 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 69.6 m -71.09 60.37 0.26 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.523 -0.736 . . . . 1.95 110.369 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.6 -49.97 74.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.507 -0.746 . . . . 1.69 110.436 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -60.01 -48.94 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 1.52 110.608 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.406 ' HB2' ' HB3' ' A' ' 2' ' ' SER . 83.0 mt -60.0 -45.02 94.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.297 -0.877 . . . . 1.92 110.604 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.426 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 33.6 t80 -59.95 -43.5 94.97 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.419 -0.801 . . . . 3.87 110.361 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.645 ' O ' HG13 ' A' ' 11' ' ' VAL . 96.2 m-20 -60.01 -40.26 88.65 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.516 -0.74 . . . . 1.35 110.736 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.609 ' HG3' HD13 ' A' ' 39' ' ' LEU . 8.8 tpt180 -60.01 -50.02 75.37 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.522 -0.736 . . . . 2.93 110.611 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.799 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.72 -40.05 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.12 -0.987 . . . . 1.07 109.253 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.99 74.17 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 112.832 0.679 . . . . 0.42 112.832 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 7' ' ' ASN . 33.4 m -60.08 -49.01 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.229 -0.92 . . . . 0.95 111.968 -177.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.598 ' CD ' HD11 ' A' ' 39' ' ' LEU . 75.6 mt-30 -62.94 -42.61 99.86 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.872 -1.143 . . . . 1.84 109.492 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.842 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -43.63 -52.6 6.39 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.695 -1.362 . . . . 0.36 109.695 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -62.68 -34.76 77.76 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.926 -0.749 . . . . 1.12 111.221 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 11' ' ' VAL . 92.0 t -59.62 -40.04 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.29 -0.881 . . . . 0.46 109.584 -179.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.616 HG22 HG23 ' A' ' 33' ' ' VAL . 55.6 t -59.99 -49.97 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 N-CA-C 108.592 -0.892 . . . . 0.7 108.592 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -64.85 -40.93 95.95 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.37 0.605 . . . . 3.15 110.536 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.0 -48.62 80.96 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.73 -0.606 . . . . 2.23 110.775 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 28' ' ' ASP . 87.1 mt -59.99 -40.51 89.44 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.643 -0.661 . . . . 1.02 110.41 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.829 ' HD3' HG21 ' A' ' 29' ' ' VAL . 35.0 tptt -69.92 -39.67 76.0 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.618 -0.882 . . . . 2.08 108.618 179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.01 -31.72 70.2 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.0 -0.741 . . . . 0.81 109.0 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.548 ' HD3' HD23 ' A' ' 19' ' ' LEU . 15.9 ptmt -92.23 19.4 7.03 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 119.529 -0.869 . . . . 2.11 110.488 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.7 mttm 59.6 20.26 8.83 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.451 -0.78 . . . . 2.28 111.678 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.4 158.7 13.82 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.413 -0.805 . . . . 0.71 109.712 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -73.25 167.23 27.85 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.322 1.169 . . . . 0.93 110.153 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -54.96 -24.56 24.52 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.522 -0.736 . . . . 2.0 109.566 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -57.02 -41.86 79.33 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.728 -0.608 . . . . 2.22 110.209 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.585 ' HB3' HD22 ' A' ' 19' ' ' LEU . 69.2 m-20 -75.44 -48.44 22.76 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.685 -0.634 . . . . 1.46 111.32 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.829 HG21 ' HD3' ' A' ' 20' ' ' LYS . 79.5 t -63.35 -49.54 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 0.65 109.786 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.95 -40.21 88.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.58 -0.7 . . . . 1.33 110.883 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.78 -51.64 68.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.301 -0.874 . . . . 0.46 110.538 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.14 90.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.629 -0.67 . . . . 0.39 109.296 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.616 HG23 HG22 ' A' ' 16' ' ' VAL . 9.1 t -64.59 -45.67 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 108.455 -0.943 . . . . 0.57 108.455 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -60.01 -40.95 91.02 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.261 -0.899 . . . . 2.82 108.822 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -65.11 -49.4 70.11 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.466 -0.939 . . . . 1.73 108.466 178.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.842 HD22 ' HA2' ' A' ' 13' ' ' GLY . 6.7 tp -60.0 -39.54 86.12 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 115.821 -0.627 . . . . 1.53 109.689 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.0 mt -58.22 -38.66 77.26 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.419 -0.8 . . . . 1.36 109.608 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.1 t -60.5 -40.7 92.32 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.607 -0.683 . . . . 1.31 109.475 178.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.799 ' HB3' HG12 ' A' ' 9' ' ' VAL . 46.4 mt -66.8 -50.95 60.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 109.008 -0.738 . . . . 0.72 109.008 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -59.99 -39.89 87.32 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.524 0.678 . . . . 2.38 109.274 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.81 80.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.907 -0.496 . . . . 0.69 110.512 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -60.04 -49.95 75.64 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.289 -0.882 . . . . 1.9 110.236 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.37 -39.96 92.55 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.573 -0.705 . . . . 2.03 110.001 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -60.0 -39.35 85.47 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.758 -0.589 . . . . 2.12 110.484 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -58.79 -37.63 76.77 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.549 -0.72 . . . . 2.41 111.12 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -61.26 -54.48 43.49 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.195 -0.941 . . . . 2.31 111.055 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.16 18.21 0.36 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.113 -0.992 . . . . 2.51 111.659 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.97 33.58 70.28 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 110.466 -1.053 . . . . 1.86 110.466 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -86.72 -13.0 46.62 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.33 -1.1 . . . . 2.7 111.628 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 35.92 -156.03 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 N-CA-C 112.807 0.669 . . . . 2.37 112.807 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -62.88 119.54 9.58 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.17 -0.956 . . . . 2.77 110.552 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 3.8 mttm -70.13 137.11 86.91 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.665 -0.647 . . . . 5.01 109.485 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -85.06 -170.79 0.82 Allowed 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.178 1.094 . . . . 3.45 110.798 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.61 21.23 78.82 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.767 -0.73 . . . . 3.07 111.287 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.42 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER 55.98 177.8 0.03 OUTLIER Pre-proline 0 N--CA 1.505 2.323 0 O-C-N 121.067 -1.255 . . . . 4.09 110.419 179.475 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 38.4 Cg_endo -69.99 150.01 66.23 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.313 1.165 . . . . 4.1 109.977 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo . . . . . 0 C--N 1.317 -1.115 0 O-C-N 123.392 1.207 . . . . 4.82 110.746 -178.535 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.42 ' O ' HG12 ' A' ' 4' ' ' VAL . 36.8 p-10 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.944 0.402 . . . . 3.98 110.346 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -66.35 -20.62 66.13 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.509 -0.745 . . . . 1.95 110.489 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.4 ' C ' HD23 ' A' ' 3' ' ' LEU . 7.9 tt -59.95 -41.78 92.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.367 -0.833 . . . . 1.69 110.729 -178.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.479 HG13 HD22 ' A' ' 5' ' ' LEU . 2.9 p -56.23 -40.88 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 O-C-N 121.272 -0.892 . . . . 1.52 110.461 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.479 HD22 HG13 ' A' ' 4' ' ' VAL . 3.5 mm? -59.79 -40.63 88.99 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.558 -0.714 . . . . 1.92 109.633 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.428 ' O ' HG22 ' A' ' 9' ' ' VAL . 10.3 m-85 -59.94 -40.12 87.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.611 -0.681 . . . . 3.87 110.016 178.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.832 ' O ' HG23 ' A' ' 11' ' ' VAL . 97.6 m-20 -61.47 -41.47 97.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.618 -0.676 . . . . 1.35 110.704 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttt85 -59.95 -49.73 76.55 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.541 -0.725 . . . . 2.93 111.101 -178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.911 ' HA ' HD13 ' A' ' 39' ' ' LEU . 33.1 m -66.72 -39.83 84.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.437 -0.789 . . . . 1.07 108.93 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.404 ' CB ' ' HD3' ' A' ' 56' ' ' PRO . . . -60.84 -38.57 85.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.797 -0.565 . . . . 0.42 110.97 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 7' ' ' ASN . 60.1 t -60.02 -49.95 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.455 -0.778 . . . . 0.95 109.985 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.843 ' HG3' HD11 ' A' ' 39' ' ' LEU . 99.6 mm-40 -60.22 -51.91 67.54 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.078 -1.014 . . . . 1.84 109.283 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.01 -58.26 2.34 Favored Glycine 0 N--CA 1.506 3.331 0 N-CA-C 110.68 -0.968 . . . . 0.36 110.68 -178.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.66 -38.52 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.912 -0.758 . . . . 1.12 111.088 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 11' ' ' VAL . 85.2 t -59.75 -39.96 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.313 -0.867 . . . . 0.46 109.683 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.552 HG22 ' CB ' ' A' ' 32' ' ' ALA . 60.1 t -60.04 -49.76 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 N-CA-C 108.864 -0.791 . . . . 0.7 108.864 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -59.98 -43.48 95.1 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.72 -0.612 . . . . 3.15 110.103 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.58 -41.55 97.57 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 2.23 111.341 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.35 -42.92 96.76 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.24 -0.913 . . . . 1.02 109.9 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.57 ' CD ' HG21 ' A' ' 29' ' ' VAL . 20.0 tptp -65.75 -40.0 91.67 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.794 -0.817 . . . . 2.08 108.794 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -26.69 66.72 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.725 -0.842 . . . . 0.81 108.725 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -86.97 10.28 16.85 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.113 -0.635 . . . . 2.11 110.793 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 94.4 mttt 57.35 21.38 6.74 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.294 -0.879 . . . . 2.28 111.091 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.418 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -60.87 162.47 12.22 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.615 -0.678 . . . . 0.71 109.406 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.46 162.69 39.64 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.211 1.111 . . . . 0.93 111.047 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -54.48 -24.45 20.42 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.735 -0.603 . . . . 2.0 110.197 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -59.53 -40.94 88.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.643 -0.661 . . . . 2.22 110.059 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 70.0 m-20 -72.61 -45.61 58.24 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.482 -0.761 . . . . 1.46 110.843 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.57 HG21 ' CD ' ' A' ' 20' ' ' LYS . 87.1 t -67.02 -50.77 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.553 -0.717 . . . . 0.65 110.305 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' HG12 ' A' ' 33' ' ' VAL . 86.3 m-20 -60.13 -43.62 95.54 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.573 -0.705 . . . . 1.33 111.121 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.01 73.47 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.381 -0.824 . . . . 0.46 110.655 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.552 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -65.38 -42.53 92.59 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 120.261 -0.576 . . . . 0.39 110.492 -179.372 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.67 -36.57 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.084 -1.08 . . . . 0.57 108.084 179.214 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -60.06 -44.13 94.93 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.98 -1.118 . . . . 2.82 107.98 177.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -62.44 -40.03 95.29 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.85 0.833 . . . . 1.73 108.852 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.882 HD22 HD12 ' A' ' 39' ' ' LEU . 2.8 tm? -59.71 -41.5 90.96 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.4 -0.593 . . . . 1.53 109.4 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.4 mt -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.575 -0.703 . . . . 1.36 110.39 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 p -62.12 -27.92 69.27 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.355 -0.841 . . . . 1.31 109.495 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.911 HD13 ' HA ' ' A' ' 9' ' ' VAL . 83.1 mt -66.9 -58.57 4.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.265 -0.897 . . . . 0.72 109.131 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.412 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 1.3 ptpm? -61.77 -35.53 78.41 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.762 0.791 . . . . 2.38 109.072 178.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.412 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -59.98 -50.05 75.26 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 116.106 -0.497 . . . . 0.69 109.948 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.34 -40.06 93.16 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.508 -0.745 . . . . 1.9 109.759 179.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.46 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -58.98 -39.59 82.22 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.682 -0.636 . . . . 2.03 109.989 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -59.94 -40.04 87.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.604 -0.685 . . . . 2.12 111.046 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.9 -39.25 80.92 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.397 -0.814 . . . . 2.41 111.238 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.673 ' O ' HG23 ' A' ' 47' ' ' THR . 58.4 mttm -64.94 -59.95 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.28 -0.968 . . . . 2.31 110.767 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.673 HG23 ' O ' ' A' ' 46' ' ' LYS . 1.0 OUTLIER -159.46 12.52 0.14 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.254 -0.904 . . . . 2.51 112.741 -179.771 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.84 55.23 20.75 Favored Glycine 0 N--CA 1.498 2.821 0 N-CA-C 109.169 -1.573 . . . . 1.86 109.169 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.46 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 97.1 mt-30 -83.22 -20.49 34.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.579 -0.954 . . . . 2.7 111.61 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 30.28 85.8 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.986 0 N-CA-C 112.892 0.701 . . . . 2.37 112.892 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -56.09 147.73 19.51 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.449 -0.782 . . . . 2.77 111.252 -178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -67.08 156.27 88.26 Favored Pre-proline 0 N--CA 1.5 2.063 0 O-C-N 121.587 -0.696 . . . . 5.01 110.572 -179.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.25 -13.62 23.19 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.352 1.185 . . . . 3.45 112.066 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.97 44.95 3.4 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 119.611 -1.28 . . . . 3.07 111.86 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.433 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.4 OUTLIER 53.34 -178.81 0.02 OUTLIER Pre-proline 0 N--CA 1.506 2.349 0 O-C-N 120.946 -1.326 . . . . 4.09 110.328 179.0 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 37.2 Cg_endo -70.0 150.03 66.18 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.106 1.056 . . . . 4.1 110.373 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo . . . . . 0 C--N 1.319 -1.004 0 O-C-N 123.388 1.204 . . . . 4.82 110.695 -178.841 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 121.069 0.461 . . . . 3.98 110.514 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -62.11 -40.01 94.45 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.617 -0.677 . . . . 1.95 110.736 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp -60.75 -45.83 92.79 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.78 . . . . 1.69 110.114 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 90.5 t -59.22 -40.11 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.836 -0.54 . . . . 1.52 110.425 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.04 -48.8 80.2 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.417 -0.802 . . . . 1.92 110.565 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.42 ' CE2' ' O ' ' A' ' 56' ' ' PRO . 13.3 m-85 -59.88 -39.76 86.38 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.519 -0.738 . . . . 3.87 110.796 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.799 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.5 m-20 -59.91 -39.46 85.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.419 -0.801 . . . . 1.35 110.171 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.1 mmt-85 -59.93 -50.72 72.66 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.502 -0.749 . . . . 2.93 110.342 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.873 ' HA ' HD13 ' A' ' 39' ' ' LEU . 35.5 m -67.79 -40.04 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 C-N-CA 119.48 -0.888 . . . . 1.07 109.348 178.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.96 -36.79 77.86 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.571 -0.706 . . . . 0.42 110.278 178.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 7' ' ' ASN . 40.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.486 -0.759 . . . . 0.95 111.305 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.524 ' CD ' HD11 ' A' ' 39' ' ' LEU . 2.8 mp0 -60.0 -52.62 64.62 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.045 -1.034 . . . . 1.84 110.055 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.551 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -42.11 -54.85 4.4 Favored Glycine 0 N--CA 1.508 3.485 0 N-CA-C 110.178 -1.169 . . . . 0.36 110.178 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -65.61 -38.3 89.05 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.837 -0.802 . . . . 1.12 111.72 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 11' ' ' VAL . 54.5 t -59.68 -40.01 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.219 -0.925 . . . . 0.46 109.233 -178.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.3 t -60.0 -49.99 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.398 -0.814 . . . . 0.7 109.368 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -60.0 -43.36 95.23 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.441 -0.787 . . . . 3.15 109.761 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -60.34 -47.61 85.28 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.756 -0.59 . . . . 2.23 110.772 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.96 -44.04 94.67 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.61 -0.682 . . . . 1.02 110.591 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.677 ' HD3' HG21 ' A' ' 29' ' ' VAL . 38.3 tptt -65.69 -40.3 92.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.521 -0.737 . . . . 2.08 109.146 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.78 -26.54 68.68 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.499 -0.926 . . . . 0.81 108.499 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 45.6 mtpt -87.74 12.01 13.9 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.754 -0.591 . . . . 2.11 110.644 179.234 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.8 mtmt 59.8 20.8 9.64 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.383 -0.823 . . . . 2.28 111.195 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.87 161.78 6.18 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.461 -0.774 . . . . 0.71 109.663 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.22 162.1 43.55 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.379 1.2 . . . . 0.93 110.333 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -55.64 -27.35 49.28 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.589 -0.694 . . . . 2.0 110.028 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -59.97 -39.95 87.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.73 -0.607 . . . . 2.22 110.294 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -70.53 -43.12 70.24 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.205 -0.934 . . . . 1.46 110.676 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.677 HG21 ' HD3' ' A' ' 20' ' ' LYS . 61.4 t -69.36 -51.96 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.485 -0.759 . . . . 0.65 110.047 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' HG12 ' A' ' 33' ' ' VAL . 61.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 1.33 110.879 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.81 -47.48 83.26 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.382 -0.824 . . . . 0.46 110.399 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.95 84.62 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.09 -0.644 . . . . 0.39 110.279 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -64.66 -35.93 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.304 -0.998 . . . . 0.57 108.304 179.344 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -60.08 -42.86 95.49 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.318 -0.993 . . . . 2.82 108.318 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -60.58 -40.0 90.1 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.326 -0.99 . . . . 1.73 108.326 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.696 HD23 HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -54.85 -44.29 73.84 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.804 -0.634 . . . . 1.53 110.54 179.565 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.444 -0.785 . . . . 1.36 109.699 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.0 t -59.87 -32.68 70.94 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.297 -0.631 . . . . 1.31 109.297 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.873 HD13 ' HA ' ' A' ' 9' ' ' VAL . 78.8 mt -65.52 -57.97 6.92 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 120.077 -0.649 . . . . 0.72 109.416 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.02 -33.44 72.0 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.421 -0.799 . . . . 2.38 109.607 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.48 -42.24 91.61 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.267 -0.573 . . . . 0.69 109.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.02 -48.14 82.95 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 107.98 -1.119 . . . . 1.9 107.98 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -60.29 -39.05 85.54 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.723 0.773 . . . . 2.03 109.417 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -60.01 -33.08 71.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.831 -0.543 . . . . 2.12 111.065 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.46 -39.97 71.03 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.463 -0.773 . . . . 2.41 110.14 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.83 -74.93 0.1 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.506 -0.746 . . . . 2.31 109.868 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.3 t -160.05 30.17 0.18 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.473 -0.767 . . . . 2.51 110.241 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.18 68.4 1.65 Allowed Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.517 -1.433 . . . . 1.86 109.517 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -88.41 -26.85 21.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.586 -0.949 . . . . 2.7 111.428 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 11.2 pt-20 31.23 97.56 0.0 OUTLIER 'General case' 0 N--CA 1.519 3.003 0 N-CA-C 112.772 0.656 . . . . 2.37 112.772 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.46 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 46.7 p90 -54.65 139.22 39.41 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.103 -0.998 . . . . 2.77 111.52 -178.458 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -63.76 169.64 4.05 Favored Pre-proline 0 N--CA 1.498 1.939 0 N-CA-C 109.521 -0.548 . . . . 5.01 109.521 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -64.3 -34.48 55.36 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 122.994 0.997 . . . . 3.45 110.299 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.89 -1.27 87.12 Favored Glycine 0 N--CA 1.492 2.432 0 C-N-CA 119.523 -1.322 . . . . 3.07 110.574 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.475 ' ND2' ' O ' ' A' ' 55' ' ' ASN . 2.4 p-10 39.93 50.5 3.39 Favored Pre-proline 0 N--CA 1.507 2.404 0 CA-C-N 117.994 0.897 . . . . 4.09 112.474 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' O ' ' CE2' ' A' ' 6' ' ' TYR . 39.6 Cg_endo -69.98 149.98 66.26 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.087 1.046 . . . . 4.1 110.573 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 N--CA 1.489 1.218 0 O-C-N 123.469 1.247 . . . . 4.82 110.805 179.92 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 121.029 0.442 . . . . 3.98 110.278 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.4 p -65.39 -36.98 85.61 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.584 -0.697 . . . . 1.95 110.303 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.2 tp -60.04 -40.22 88.62 Favored 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 121.68 0.752 . . . . 1.69 109.467 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.18 -44.47 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.984 -0.448 . . . . 1.52 109.945 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.02 -44.93 94.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.431 -0.793 . . . . 1.92 109.496 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -60.06 -41.65 92.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.743 -0.598 . . . . 3.87 111.27 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.691 ' O ' HG23 ' A' ' 11' ' ' VAL . 26.9 m120 -60.04 -40.63 90.07 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.472 -0.768 . . . . 1.35 111.213 -178.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.4 mtp180 -60.03 -50.37 73.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.383 -0.823 . . . . 2.93 110.503 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.782 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.67 -40.03 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.754 -0.832 . . . . 1.07 108.754 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -38.46 82.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.708 -0.62 . . . . 0.42 110.554 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.691 HG23 ' O ' ' A' ' 7' ' ' ASN . 30.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.553 -0.717 . . . . 0.95 110.46 -179.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -60.67 -53.58 55.76 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.259 -0.9 . . . . 1.84 109.738 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.735 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -39.32 -55.5 2.48 Favored Glycine 0 N--CA 1.51 3.567 0 N-CA-C 110.632 -0.987 . . . . 0.36 110.632 -178.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -61.95 -38.52 88.8 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.92 -0.753 . . . . 1.12 111.388 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' ' 11' ' ' VAL . 99.4 t -59.94 -41.96 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.319 -0.863 . . . . 0.46 109.51 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.9 t -60.7 -47.65 92.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 0.7 109.378 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -59.99 -41.14 91.42 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.56 -0.713 . . . . 3.15 110.502 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.95 -40.99 97.69 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.515 -0.74 . . . . 2.23 111.201 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.99 -43.88 94.88 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.347 -0.845 . . . . 1.02 110.656 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.746 ' CD ' HG21 ' A' ' 29' ' ' VAL . 17.2 tptt -65.15 -39.98 93.72 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.713 -0.847 . . . . 2.08 108.713 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.95 -24.19 66.84 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.71 -0.848 . . . . 0.81 108.71 177.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -88.13 10.52 19.04 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 2.11 110.423 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt 60.08 19.92 9.14 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.375 -0.828 . . . . 2.28 111.396 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.92 163.42 9.84 Favored Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.562 -0.711 . . . . 0.71 109.968 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.2 160.49 45.16 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.321 1.169 . . . . 0.93 110.392 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -56.91 -29.49 63.08 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.623 -0.673 . . . . 2.0 111.002 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.93 -40.01 75.57 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.36 -0.838 . . . . 2.22 110.688 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -70.51 -43.37 69.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.417 -0.802 . . . . 1.46 110.576 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.746 HG21 ' CD ' ' A' ' 20' ' ' LYS . 77.7 t -68.41 -47.8 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.637 -0.664 . . . . 0.65 110.648 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -59.97 -44.05 94.68 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.391 -0.818 . . . . 1.33 110.349 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.4 76.2 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.556 -0.715 . . . . 0.46 110.138 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.05 -43.2 96.23 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.647 . . . . 0.39 110.624 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -35.29 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 108.492 -0.929 . . . . 0.57 108.492 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -60.02 -40.04 87.95 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.442 -1.318 . . . . 2.82 107.442 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -60.25 -39.96 88.62 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.209 -1.034 . . . . 1.73 108.209 177.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.735 HD11 ' HA2' ' A' ' 13' ' ' GLY . 0.6 OUTLIER -56.98 -45.03 83.24 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 116.033 -0.53 . . . . 1.53 110.173 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -38.34 72.84 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.528 -0.732 . . . . 1.36 109.871 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -61.38 -40.03 92.85 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 109.151 -0.685 . . . . 1.31 109.151 178.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.782 ' HB3' HG12 ' A' ' 9' ' ' VAL . 55.7 mt -65.99 -55.16 18.15 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.619 -0.882 . . . . 0.72 108.619 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -60.0 -36.49 77.31 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.363 0.602 . . . . 2.38 109.651 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.72 94.79 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.822 -0.549 . . . . 0.69 110.213 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.97 -48.0 83.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.269 -0.894 . . . . 1.9 109.142 178.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.6 -39.96 90.07 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.623 0.725 . . . . 2.03 109.217 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.424 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 88.6 tttt -60.05 -38.33 82.5 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.707 -0.62 . . . . 2.12 110.958 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.29 -39.96 80.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.546 -0.721 . . . . 2.41 112.11 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 mttt -61.08 -53.51 56.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.031 -1.043 . . . . 2.31 110.654 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.498 ' O ' HG22 ' A' ' 47' ' ' THR . 22.3 m -156.76 13.91 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.487 -0.758 . . . . 2.51 112.021 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.424 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 70.02 39.41 74.0 Favored Glycine 0 N--CA 1.498 2.814 0 N-CA-C 110.201 -1.16 . . . . 1.86 110.201 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 50' ' ' GLU . 45.4 mt-30 -85.59 -20.13 29.99 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.365 -1.079 . . . . 2.7 111.483 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.535 ' O ' ' O ' ' A' ' 49' ' ' GLN . 15.5 pt-20 42.09 161.92 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.704 1.24 . . . . 2.37 113.853 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -70.14 117.46 11.73 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.872 -1.142 . . . . 2.77 110.711 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.5 mtpp -70.57 149.1 95.46 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.559 -0.713 . . . . 5.01 109.902 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.52 -166.33 0.33 Allowed 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.327 1.172 . . . . 3.45 111.025 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 70.92 18.76 76.47 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.763 -0.935 . . . . 3.07 110.763 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 53.99 175.04 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.178 0 O-C-N 121.254 -1.145 . . . . 4.09 110.822 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.04 150.04 65.97 Favored 'Trans proline' 0 C--N 1.319 -1.008 0 O-C-N 123.093 1.049 . . . . 4.1 110.214 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo . . . . . 0 C--N 1.317 -1.124 0 O-C-N 123.462 1.243 . . . . 4.82 110.614 -179.639 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.505 ' O ' HG12 ' A' ' 4' ' ' VAL . 12.5 p-10 . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 120.875 0.369 . . . . 3.98 110.622 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.7 m -70.0 -14.52 62.73 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.414 -0.804 . . . . 1.95 111.194 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.527 HD23 ' C ' ' A' ' 3' ' ' LEU . 7.0 tt -61.33 -42.62 98.97 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.207 -0.933 . . . . 1.69 110.685 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.629 HG13 HD22 ' A' ' 5' ' ' LEU . 6.3 p -58.83 -39.4 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.677 -0.639 . . . . 1.52 110.379 -179.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.629 HD22 HG13 ' A' ' 4' ' ' VAL . 3.9 mm? -58.97 -46.2 88.68 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.733 -0.605 . . . . 1.92 110.426 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.443 ' O ' HG22 ' A' ' 9' ' ' VAL . 44.0 m-85 -60.0 -40.05 87.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 3.87 110.627 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.837 ' O ' HG23 ' A' ' 11' ' ' VAL . 99.5 m-20 -60.22 -40.1 88.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.255 -0.903 . . . . 1.35 110.553 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -60.05 -49.98 75.53 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.452 -0.78 . . . . 2.93 111.083 -179.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.862 HG12 ' HB3' ' A' ' 39' ' ' LEU . 32.6 m -67.6 -39.95 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 119.383 -0.927 . . . . 1.07 108.913 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.407 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -61.89 -38.14 87.2 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.708 -0.62 . . . . 0.42 111.276 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.837 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.5 t -59.99 -50.02 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.803 . . . . 0.95 110.465 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.406 ' HB3' ' HB2' ' A' ' 36' ' ' LEU . 97.8 mm-40 -60.28 -50.05 75.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.101 -1.04 . . . . 1.84 109.081 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.415 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -41.48 -56.24 3.55 Favored Glycine 0 N--CA 1.509 3.545 0 N-CA-C 110.282 -1.127 . . . . 0.36 110.282 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -61.6 -40.04 93.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.866 -0.785 . . . . 1.12 110.316 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 11' ' ' VAL . 91.9 t -59.7 -39.26 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.427 -0.796 . . . . 0.46 109.307 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.9 t -59.92 -50.06 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 N-CA-C 108.593 -0.891 . . . . 0.7 108.593 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.1 ttt85 -60.27 -41.42 93.23 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.742 -0.599 . . . . 3.15 110.178 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.6 -39.94 90.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.573 -0.705 . . . . 2.23 110.573 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.557 HD23 ' HD3' ' A' ' 22' ' ' LYS . 86.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.532 -0.73 . . . . 1.02 110.104 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HD3' HG21 ' A' ' 29' ' ' VAL . 10.5 mmtp -69.1 -40.05 78.6 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.574 0.702 . . . . 2.08 109.24 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.08 -33.56 72.24 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.105 -0.702 . . . . 0.81 109.105 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.557 ' HD3' HD23 ' A' ' 19' ' ' LEU . 14.2 ptmt -91.39 17.57 8.31 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.701 -0.8 . . . . 2.11 110.946 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt 59.59 22.38 11.04 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.359 -0.838 . . . . 2.28 111.329 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.91 151.55 23.86 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.44 -0.788 . . . . 0.71 110.26 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -69.09 170.71 15.15 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.411 1.216 . . . . 0.93 111.032 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.9 -32.63 67.91 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.195 0.521 . . . . 2.0 110.5 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -59.23 -39.97 84.41 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.6 -0.688 . . . . 2.22 111.169 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.521 ' HB3' HD22 ' A' ' 19' ' ' LEU . 80.0 m-20 -70.16 -40.57 74.66 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.414 -0.804 . . . . 1.46 110.639 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.506 HG21 ' HD3' ' A' ' 20' ' ' LYS . 83.6 t -68.57 -52.17 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.653 -0.654 . . . . 0.65 110.438 -179.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.458 ' O ' HG12 ' A' ' 33' ' ' VAL . 79.0 m-20 -60.07 -43.85 95.16 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.59 -0.694 . . . . 1.33 110.716 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.03 -47.49 86.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.448 -0.782 . . . . 0.46 110.377 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.54 -44.75 89.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.599 -0.688 . . . . 0.39 110.365 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.458 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.52 -38.21 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 108.143 -1.058 . . . . 0.57 108.143 178.852 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -60.0 -42.04 93.39 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.126 -1.064 . . . . 2.82 108.126 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -62.94 -47.16 84.42 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.353 -0.981 . . . . 1.73 108.353 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.538 ' O ' HD12 ' A' ' 36' ' ' LEU . 2.5 tp -60.01 -41.31 91.89 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.831 -0.622 . . . . 1.53 109.503 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.19 -38.36 79.64 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.59 -0.694 . . . . 1.36 109.614 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.9 t -60.77 -41.14 94.91 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.089 -0.708 . . . . 1.31 109.089 178.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 9' ' ' VAL . 63.3 mt -63.07 -50.18 71.6 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.467 -0.938 . . . . 0.72 108.467 178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.02 -40.01 87.79 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.653 0.74 . . . . 2.38 109.341 177.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -49.31 78.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.867 -0.521 . . . . 0.69 110.958 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -49.28 78.28 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.215 -0.928 . . . . 1.9 109.979 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.09 -37.01 78.68 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.572 0.701 . . . . 2.03 109.991 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.98 -40.0 87.65 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.681 -0.637 . . . . 2.12 111.297 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.08 -38.25 73.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.464 -0.773 . . . . 2.41 111.257 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.82 -55.17 36.2 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.267 -0.895 . . . . 2.31 110.849 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 47' ' ' THR . 29.7 m -158.45 16.85 0.21 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.277 -0.889 . . . . 2.51 111.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.87 37.8 75.23 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.433 -1.467 . . . . 1.86 109.433 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' O ' ' A' ' 50' ' ' GLU . 14.3 mm100 -81.5 -29.27 33.69 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.62 -0.93 . . . . 2.7 110.795 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 49' ' ' GLN . 8.5 pt-20 40.56 -172.47 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.505 0.669 . . . . 2.37 112.543 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.401 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.0 t80 -70.34 115.42 9.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.169 -0.957 . . . . 2.77 110.857 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -71.25 146.75 92.61 Favored Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.437 -0.789 . . . . 5.01 108.972 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -81.57 -52.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.161 1.085 . . . . 3.45 111.567 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.96 3.36 65.32 Favored Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.657 -1.259 . . . . 3.07 111.395 179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.475 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 13.8 m120 51.81 99.31 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.207 0 CA-C-N 118.724 1.262 . . . . 4.09 111.292 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.503 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 29.5 Cg_endo -59.97 -31.74 94.04 Favored 'Trans proline' 0 CA--C 1.553 1.445 0 O-C-N 123.115 1.061 . . . . 4.1 113.922 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 56' ' ' PRO . 47.3 Cg_endo . . . . . 0 N--CA 1.488 1.183 0 CA-C-N 119.83 0.975 . . . . 4.82 110.339 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.7 t0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.186 0.517 . . . . 3.98 110.337 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.7 p -65.69 -39.76 91.61 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.306 -0.871 . . . . 1.95 110.768 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.1 tp -64.79 -55.13 21.59 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.545 -0.722 . . . . 1.69 111.57 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 5' ' ' LEU . 10.5 p -59.02 -41.96 84.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.549 -0.719 . . . . 1.52 110.861 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.45 ' N ' HG13 ' A' ' 4' ' ' VAL . 2.6 mm? -59.97 -40.6 89.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.598 -0.689 . . . . 1.92 109.936 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.458 ' CD1' ' HB2' ' A' ' 52' ' ' LYS . 64.9 t80 -60.02 -40.0 87.8 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.479 -0.763 . . . . 3.87 109.883 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.655 ' O ' HG23 ' A' ' 11' ' ' VAL . 74.5 m-20 -59.97 -40.0 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.476 -0.765 . . . . 1.35 109.804 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -60.03 -50.43 73.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.585 -0.697 . . . . 2.93 111.269 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.675 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.0 m -70.02 -40.9 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.225 -0.922 . . . . 1.07 109.575 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.423 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -61.13 -44.69 96.94 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.612 -0.68 . . . . 0.42 111.227 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 7' ' ' ASN . 56.3 t -60.06 -46.7 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.384 -0.823 . . . . 0.95 110.362 -178.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.1 tp-100 -60.03 -49.13 78.88 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.118 -0.989 . . . . 1.84 109.347 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.474 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -39.47 -48.87 3.02 Favored Glycine 0 N--CA 1.51 3.631 0 N-CA-C 110.18 -1.168 . . . . 0.36 110.18 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.38 -34.38 78.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.879 -0.777 . . . . 1.12 110.873 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.71 -43.66 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.284 -0.885 . . . . 0.46 109.264 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.569 HG13 HG13 ' A' ' 29' ' ' VAL . 55.9 t -60.47 -45.51 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 N-CA-C 107.911 -1.144 . . . . 0.7 107.911 177.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -60.32 -40.02 89.11 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 116.04 -0.527 . . . . 3.15 110.879 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.97 -42.5 94.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.48 -0.763 . . . . 2.23 109.93 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 22' ' ' LYS . 89.1 mt -60.4 -40.18 90.0 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.493 0.663 . . . . 1.02 110.612 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.689 ' HE2' HG11 ' A' ' 29' ' ' VAL . 20.7 mmtt -68.67 -39.99 80.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.392 -0.818 . . . . 2.08 109.052 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -30.86 69.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.073 -0.714 . . . . 0.81 109.073 178.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.448 ' HG2' ' HA ' ' A' ' 19' ' ' LEU . 17.7 ptpt -94.31 19.33 9.62 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.771 -0.771 . . . . 2.11 110.773 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? 56.9 24.47 9.36 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.423 -0.798 . . . . 2.28 111.082 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.86 59.62 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.66 -0.65 . . . . 0.71 110.369 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.71 159.38 51.44 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.473 1.249 . . . . 0.93 110.684 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -55.17 -27.53 46.34 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.672 -0.642 . . . . 2.0 109.611 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -59.32 -40.12 85.26 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.787 -0.571 . . . . 2.22 110.047 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' 19' ' ' LEU . 74.3 m-20 -70.73 -45.52 64.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.535 -0.728 . . . . 1.46 110.006 179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.689 HG11 ' HE2' ' A' ' 20' ' ' LYS . 66.9 t -67.31 -40.49 84.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.737 -0.602 . . . . 0.65 109.801 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.425 ' O ' HG12 ' A' ' 33' ' ' VAL . 77.9 m-20 -60.07 -49.01 79.34 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.596 -0.69 . . . . 1.33 110.943 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.19 91.14 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.191 -0.943 . . . . 0.46 110.562 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.27 89.02 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.39 110.837 -179.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.499 ' O ' HD23 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -66.25 -39.49 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.239 -0.913 . . . . 0.57 108.646 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -60.2 -40.88 91.62 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.173 -1.047 . . . . 2.82 108.173 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -65.72 -44.68 85.3 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.126 -1.064 . . . . 1.73 108.126 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 39' ' ' LEU . 14.4 tp -59.06 -48.86 80.07 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 115.54 -0.754 . . . . 1.53 110.176 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.544 HD13 ' HD2' ' A' ' 40' ' ' LYS . 4.1 mm? -58.4 -37.46 75.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.318 -0.864 . . . . 1.36 109.657 179.093 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -59.97 -36.76 77.83 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.545 -0.722 . . . . 1.31 109.339 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.675 ' HB3' HG12 ' A' ' 9' ' ' VAL . 94.0 mt -59.95 -41.49 91.99 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.505 -0.747 . . . . 0.72 109.283 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.544 ' HD2' HD13 ' A' ' 37' ' ' LEU . 98.3 mttt -62.7 -40.44 97.13 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 120.149 -0.62 . . . . 2.38 109.511 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -40.61 89.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.79 -0.569 . . . . 0.69 110.498 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -60.15 -48.7 80.64 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.517 -0.739 . . . . 1.9 109.639 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -60.04 -40.44 89.39 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 2.03 110.031 179.142 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.435 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 97.9 mttt -62.71 -23.85 67.36 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.725 -0.609 . . . . 2.12 111.979 -179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.07 -39.97 79.87 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.272 -0.893 . . . . 2.41 111.014 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.611 ' O ' HG23 ' A' ' 47' ' ' THR . 42.1 mmtm -64.26 -56.14 16.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.538 -0.726 . . . . 2.31 110.657 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 46' ' ' LYS . 0.2 OUTLIER -163.21 27.28 0.09 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.461 -0.774 . . . . 2.51 110.804 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.435 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 71.62 41.1 57.92 Favored Glycine 0 N--CA 1.497 2.737 0 C-N-CA 120.012 -1.09 . . . . 1.86 110.387 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 70.7 mt-30 -83.45 -23.01 32.44 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.31 -1.112 . . . . 2.7 110.897 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 36.7 -157.55 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 112.602 0.593 . . . . 2.37 112.602 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.41 ' HH ' ' HH ' ' A' ' 6' ' ' TYR . 64.8 t80 -64.66 123.66 19.89 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.364 -0.835 . . . . 2.77 110.46 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.458 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 51.6 mmtt -68.51 136.81 90.78 Favored Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.529 -0.732 . . . . 5.01 109.424 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 52' ' ' LYS . 51.9 Cg_endo -88.96 176.65 3.2 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.167 1.088 . . . . 3.45 111.38 -179.074 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 70.37 28.86 70.68 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 111.08 -0.808 . . . . 3.07 111.08 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 54.66 178.49 0.03 OUTLIER Pre-proline 0 N--CA 1.506 2.346 0 O-C-N 121.039 -1.271 . . . . 4.09 110.113 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.01 149.98 66.02 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.046 1.024 . . . . 4.1 109.902 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo . . . . . 0 C--N 1.317 -1.095 0 O-C-N 123.334 1.176 . . . . 4.82 110.699 -179.418 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.25 0.548 . . . . 3.98 110.586 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.2 p -66.72 -25.28 66.45 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.669 -0.644 . . . . 1.95 110.597 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.532 HD23 ' C ' ' A' ' 3' ' ' LEU . 10.5 tt -60.82 -43.69 97.88 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.406 -0.809 . . . . 1.69 110.005 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 70.0 t -58.8 -49.29 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.864 -0.523 . . . . 1.52 110.062 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.99 -39.99 87.62 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.658 . . . . 1.92 110.625 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -58.68 -40.98 85.14 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.44 -0.787 . . . . 3.87 110.59 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' ' 11' ' ' VAL . 4.9 m-80 -60.44 -40.38 90.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.612 -0.68 . . . . 1.35 111.421 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -59.97 -53.05 62.42 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.284 -0.885 . . . . 2.93 110.738 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.863 HG12 ' HB3' ' A' ' 39' ' ' LEU . 28.8 m -69.87 -40.06 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.587 -0.696 . . . . 1.07 109.763 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.472 ' HB1' ' CG ' ' A' ' 55' ' ' ASN . . . -60.15 -43.58 95.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.757 -0.589 . . . . 0.42 111.464 179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.4 t -59.96 -49.23 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.422 -0.799 . . . . 0.95 110.406 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -59.98 -50.14 74.92 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.023 -1.048 . . . . 1.84 109.47 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.648 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -38.77 -49.47 2.51 Favored Glycine 0 N--CA 1.509 3.521 0 N-CA-C 110.654 -0.978 . . . . 0.36 110.654 -178.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -64.53 -37.6 88.12 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.868 -0.783 . . . . 1.12 110.979 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.94 -40.06 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.407 -0.808 . . . . 0.46 109.815 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.472 HG22 ' CB ' ' A' ' 32' ' ' ALA . 83.1 t -59.92 -50.34 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.938 . . . . 0.7 108.826 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -62.53 -40.01 95.41 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.553 0.692 . . . . 3.15 109.783 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.0 tp10 -59.95 -42.44 94.04 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.863 -0.523 . . . . 2.23 111.341 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.727 HD13 ' HB3' ' A' ' 28' ' ' ASP . 89.8 mt -59.95 -44.88 94.12 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.777 0.799 . . . . 1.02 109.928 -179.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.749 ' HD2' HG13 ' A' ' 29' ' ' VAL . 17.3 mtpt -69.97 -37.49 75.81 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.497 -0.927 . . . . 2.08 108.497 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.48 70.9 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.708 -0.849 . . . . 0.81 108.708 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.541 ' HE2' HD23 ' A' ' 19' ' ' LEU . 43.8 pttt -93.91 20.93 7.14 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 119.552 -0.859 . . . . 2.11 110.611 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt 60.05 20.38 9.54 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.532 -0.73 . . . . 2.28 111.926 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.521 ' HB2' ' CE ' ' A' ' 22' ' ' LYS . . . -58.19 163.06 4.91 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.424 -0.798 . . . . 0.71 110.614 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -76.77 166.52 26.89 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.449 1.236 . . . . 0.93 111.128 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -58.21 -28.27 64.67 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.736 -0.603 . . . . 2.0 111.316 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -57.67 -40.07 78.54 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.143 -0.973 . . . . 2.22 110.423 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.727 ' HB3' HD13 ' A' ' 19' ' ' LEU . 10.3 m-20 -71.84 -39.98 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.68 0.752 . . . . 1.46 109.52 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.749 HG13 ' HD2' ' A' ' 20' ' ' LYS . 61.1 t -66.95 -53.36 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-N 116.224 -0.444 . . . . 0.65 110.439 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' HG12 ' A' ' 33' ' ' VAL . 86.7 m-20 -59.95 -48.0 83.5 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.567 -0.708 . . . . 1.33 111.269 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.98 83.64 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.298 -0.877 . . . . 0.46 110.519 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.472 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -66.43 -40.01 89.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.647 -0.658 . . . . 0.39 110.554 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.99 -40.04 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.489 -0.884 . . . . 0.57 108.73 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.15 -40.29 93.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.046 -1.062 . . . . 2.82 108.364 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -66.12 -47.16 75.06 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.806 -0.812 . . . . 1.73 108.806 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.648 HD22 ' HA2' ' A' ' 13' ' ' GLY . 3.6 tp -60.06 -43.73 95.22 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.95 -0.469 . . . . 1.53 110.062 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.1 mt -59.98 -39.13 84.61 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.489 -0.757 . . . . 1.36 109.714 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.6 m -60.0 -39.53 86.09 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.271 -0.641 . . . . 1.31 109.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.863 ' HB3' HG12 ' A' ' 9' ' ' VAL . 81.9 mt -60.21 -55.45 33.58 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.435 -0.79 . . . . 0.72 109.91 179.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.555 ' HE3' HD11 ' A' ' 36' ' ' LEU . 98.4 mttt -60.91 -38.56 86.15 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.482 -0.762 . . . . 2.38 109.65 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.65 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 120.433 -0.507 . . . . 0.69 110.592 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.13 -50.95 71.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.124 -0.985 . . . . 1.9 109.792 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -63.54 -39.2 93.8 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.749 0.785 . . . . 2.03 109.801 178.776 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -60.01 -39.29 85.32 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.872 -0.518 . . . . 2.12 111.013 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -55.44 -37.77 68.15 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.422 -0.799 . . . . 2.41 111.023 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -63.07 -56.4 17.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.253 -0.905 . . . . 2.31 111.322 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.598 HG22 ' O ' ' A' ' 47' ' ' THR . 34.5 m -157.14 18.14 0.29 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.295 -0.878 . . . . 2.51 111.848 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.76 52.25 30.53 Favored Glycine 0 N--CA 1.496 2.655 0 N-CA-C 108.679 -1.769 . . . . 1.86 108.679 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.468 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 90.3 mm-40 -76.63 -37.64 56.01 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.888 . . . . 2.7 111.472 -178.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 32.7 96.83 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.963 0 N-CA-C 112.711 0.634 . . . . 2.37 112.711 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 41.0 p90 -55.66 143.97 28.5 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.911 -1.118 . . . . 2.77 110.467 -179.041 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.61 157.65 77.84 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.665 -0.647 . . . . 5.01 110.967 -178.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -70.49 -7.18 20.67 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.586 1.309 . . . . 3.45 111.46 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.99 1.96 77.27 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 119.82 -1.181 . . . . 3.07 111.405 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.472 ' CG ' ' HB1' ' A' ' 10' ' ' ALA . 0.4 OUTLIER 55.8 174.72 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.251 0 O-C-N 120.984 -1.303 . . . . 4.09 110.801 179.708 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.02 150.04 66.09 Favored 'Trans proline' 0 N--CA 1.487 1.116 0 O-C-N 123.522 1.275 . . . . 4.1 110.567 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.487 1.105 0 O-C-N 123.464 1.244 . . . . 4.82 110.682 -179.583 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-O 120.89 0.376 . . . . 1.69 110.534 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.97 -49.93 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.327 -0.858 . . . . 1.52 109.626 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 5' ' ' LEU . 4.5 mm? -60.0 -33.3 71.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.468 -0.77 . . . . 1.92 109.214 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -48.61 79.61 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.473 0.654 . . . . 3.87 110.069 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.786 ' O ' HG23 ' A' ' 11' ' ' VAL . 31.2 m120 -61.78 -40.04 93.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.724 -0.61 . . . . 1.35 112.017 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.414 ' HG2' HD13 ' A' ' 39' ' ' LEU . 41.7 ttt180 -59.98 -51.69 68.6 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.26 -0.9 . . . . 2.93 111.7 -177.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.421 HG13 ' N ' ' A' ' 10' ' ' ALA . 11.5 p -66.87 -40.0 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.126 -0.984 . . . . 1.07 109.389 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.421 ' N ' HG13 ' A' ' 9' ' ' VAL . . . -59.94 -40.92 90.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.737 -0.602 . . . . 0.42 111.081 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.7 t -60.28 -50.02 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.464 -0.772 . . . . 0.95 110.644 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -62.85 -51.79 65.65 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.17 -0.957 . . . . 1.84 109.739 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.1 -51.6 2.73 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.593 -1.003 . . . . 0.36 110.593 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -64.55 -39.02 92.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.899 -0.765 . . . . 1.12 111.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 11' ' ' VAL . 75.8 t -59.79 -42.75 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.345 -0.847 . . . . 0.46 109.693 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.427 HG21 ' HA ' ' A' ' 33' ' ' VAL . 54.5 t -60.01 -48.98 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.7 109.819 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.0 -42.31 94.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.719 -0.613 . . . . 3.15 110.622 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -61.26 -48.26 82.27 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.605 -0.685 . . . . 2.23 111.244 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.2 mt -60.0 -42.11 93.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.675 -0.64 . . . . 1.02 111.298 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' CD ' HG21 ' A' ' 29' ' ' VAL . 30.4 tptt -63.99 -40.02 95.42 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.479 -0.934 . . . . 2.08 108.479 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.48 67.71 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.607 -0.886 . . . . 0.81 108.607 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 36.1 mtpt -85.08 8.92 16.29 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.741 -0.599 . . . . 2.11 110.986 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 55.7 mtmt 58.64 21.54 8.87 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.204 -0.935 . . . . 2.28 110.894 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -57.66 166.46 1.8 Allowed Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.562 -0.711 . . . . 0.71 110.418 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 43.5 Cg_endo -68.76 161.26 46.19 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.436 1.23 . . . . 0.93 110.207 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -56.84 -29.53 62.92 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.557 -0.715 . . . . 2.0 110.63 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.66 -39.88 85.9 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.533 -0.73 . . . . 2.22 110.988 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.07 -44.57 68.86 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 1.46 110.589 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.507 HG21 ' CD ' ' A' ' 20' ' ' LYS . 96.9 t -68.6 -48.56 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.713 -0.617 . . . . 0.65 110.256 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.5 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.9 m-20 -60.04 -49.49 77.45 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.509 -0.744 . . . . 1.33 111.503 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.77 84.21 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.14 -0.975 . . . . 0.46 110.427 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -64.76 -41.13 96.13 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 120.296 -0.561 . . . . 0.39 110.803 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.07 -37.13 79.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.257 -1.016 . . . . 0.57 108.257 179.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.24 -40.08 88.99 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.924 -0.769 . . . . 2.82 108.924 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.37 -50.68 72.64 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.883 -0.511 . . . . 1.73 110.219 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.483 HD12 ' C ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -60.21 -38.42 83.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.605 -0.684 . . . . 1.53 109.669 179.431 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.57 HD23 ' HE2' ' A' ' 40' ' ' LYS . 12.7 mt -58.0 -41.31 82.79 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.541 -0.724 . . . . 1.36 109.986 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.8 m -60.27 -39.98 88.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.577 -0.702 . . . . 1.31 109.326 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.414 HD13 ' HG2' ' A' ' 8' ' ' ARG . 43.2 mt -67.82 -43.21 80.12 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.007 -0.677 . . . . 0.72 109.279 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.57 ' HE2' HD23 ' A' ' 37' ' ' LEU . 36.5 ttpt -60.01 -39.19 84.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.74 -0.6 . . . . 2.38 109.921 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -42.16 91.93 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.262 -0.575 . . . . 0.69 110.453 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.14 -41.39 98.22 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.332 -0.855 . . . . 1.9 109.875 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -40.46 89.58 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.953 0.882 . . . . 2.03 109.541 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -60.03 -34.17 73.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.905 -0.497 . . . . 2.12 111.177 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -56.1 -40.01 73.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.563 -0.711 . . . . 2.41 111.834 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -62.2 -57.83 10.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.085 -1.009 . . . . 2.31 111.329 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.3 m -156.21 25.16 0.36 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.135 -0.978 . . . . 2.51 111.155 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.95 36.27 64.95 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.607 -0.997 . . . . 1.86 110.607 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -85.18 -15.85 42.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.402 -1.058 . . . . 2.7 111.43 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 38.05 -166.37 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.009 0.744 . . . . 2.37 113.009 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.4 ' CD1' HG22 ' A' ' 9' ' ' VAL . 45.3 t80 . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.184 -0.948 . . . . 2.77 110.207 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 121.281 0.562 . . . . 1.69 110.393 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 86.9 t -59.95 -45.53 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.68 -0.638 . . . . 1.52 110.655 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 86.9 mt -59.96 -39.95 87.35 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.374 -0.829 . . . . 1.92 109.868 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' A' ' 51' ' ' TYR . 2.5 m-85 -57.63 -38.54 75.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.685 -0.634 . . . . 3.87 109.947 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.816 ' O ' HG23 ' A' ' 11' ' ' VAL . 96.3 m-20 -60.05 -40.02 88.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.585 -0.697 . . . . 1.35 110.315 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 mtp85 -59.97 -50.99 71.59 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.373 -0.83 . . . . 2.93 110.886 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.783 ' HA ' HD13 ' A' ' 39' ' ' LEU . 25.1 m -69.54 -38.09 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 108.238 -1.023 . . . . 1.07 108.238 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.07 -39.33 85.66 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 116.098 -0.501 . . . . 0.42 110.543 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.6 t -60.03 -50.02 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.378 -0.826 . . . . 0.95 109.96 -179.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.44 -50.22 74.45 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.151 -0.968 . . . . 1.84 109.392 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.67 -55.49 3.23 Favored Glycine 0 N--CA 1.507 3.388 0 N-CA-C 110.143 -1.183 . . . . 0.36 110.143 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -65.0 -35.61 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.934 -0.745 . . . . 1.12 110.854 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 11' ' ' VAL . 86.0 t -60.01 -40.0 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 121.263 -0.898 . . . . 0.46 109.666 -179.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.02 -49.0 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 N-CA-C 108.902 -0.777 . . . . 0.7 108.902 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.8 ttp85 -60.32 -43.12 96.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.866 -0.521 . . . . 3.15 110.444 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.99 -41.7 97.42 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.41 -0.806 . . . . 2.23 111.406 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.76 -40.51 92.74 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.42 -0.8 . . . . 1.02 110.424 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' CD ' HG21 ' A' ' 29' ' ' VAL . 39.7 tptt -67.2 -40.09 86.43 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.127 -0.694 . . . . 2.08 109.127 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.46 -26.26 66.63 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.739 -0.837 . . . . 0.81 108.739 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -86.22 9.18 18.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.725 -0.609 . . . . 2.11 110.391 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 56.7 21.37 5.83 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.279 -0.888 . . . . 2.28 111.073 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.443 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -59.24 163.56 5.99 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.586 -0.696 . . . . 0.71 109.933 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.443 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 42.3 Cg_endo -67.82 162.32 40.08 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 O-C-N 123.484 1.255 . . . . 0.93 111.292 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -55.28 -27.4 46.42 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.754 -0.591 . . . . 2.0 110.258 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -58.66 -40.0 82.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.62 -0.675 . . . . 2.22 110.461 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -71.15 -45.35 63.71 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -0.81 . . . . 1.46 110.869 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.507 HG21 ' CD ' ' A' ' 20' ' ' LYS . 82.5 t -68.55 -50.0 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.497 -0.752 . . . . 0.65 110.164 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.445 ' O ' HG12 ' A' ' 33' ' ' VAL . 71.4 m-20 -59.98 -46.16 90.34 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 1.33 110.871 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.39 82.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.255 -0.903 . . . . 0.46 110.404 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.15 -42.26 89.28 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 120.086 -0.645 . . . . 0.39 110.496 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.505 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -65.93 -39.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 N-CA-C 108.358 -0.978 . . . . 0.57 108.358 179.331 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -61.06 -42.28 98.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.997 -1.112 . . . . 2.82 107.997 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -65.32 -42.45 92.98 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.833 -1.173 . . . . 1.73 107.833 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.505 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 15.4 tp -60.03 -46.63 88.89 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.737 -0.665 . . . . 1.53 110.0 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.42 -38.4 80.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.272 -0.892 . . . . 1.36 109.575 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 t -59.74 -34.51 73.04 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.644 . . . . 1.31 109.633 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.783 HD13 ' HA ' ' A' ' 9' ' ' VAL . 93.0 mt -60.0 -48.91 79.76 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.473 -0.767 . . . . 0.72 109.5 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.93 -39.93 91.28 Favored 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.774 0.797 . . . . 2.38 109.109 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -43.97 94.85 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 116.177 -0.465 . . . . 0.69 110.566 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.97 -50.68 72.81 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.302 -0.874 . . . . 1.9 109.655 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.421 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -64.47 -38.28 90.46 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.814 0.816 . . . . 2.03 109.718 178.591 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.9 tttp -60.0 -39.05 84.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.928 -0.483 . . . . 2.12 111.815 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -54.86 -39.03 68.21 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.386 -0.821 . . . . 2.41 112.003 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -62.58 -60.01 4.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.009 -1.057 . . . . 2.31 111.325 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.9 m -156.26 23.47 0.36 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.287 -0.883 . . . . 2.51 110.876 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.04 63.11 3.6 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 109.385 -1.486 . . . . 1.86 109.385 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 95.7 mm-40 -83.82 -41.5 17.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.495 -1.003 . . . . 2.7 111.823 -179.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 8.0 pt-20 33.54 92.14 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.86 0 CA-C-O 121.584 0.706 . . . . 2.37 112.113 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.406 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 53.3 p90 . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.107 -0.995 . . . . 2.77 111.248 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 54.0 tp . . . . . 0 N--CA 1.496 1.869 0 CA-C-O 121.662 0.744 . . . . 1.69 109.113 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.464 HG13 ' N ' ' A' ' 5' ' ' LEU . 9.9 p -58.02 -40.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 121.354 0.597 . . . . 1.52 110.531 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.464 ' N ' HG13 ' A' ' 4' ' ' VAL . 8.0 tt -60.02 -40.72 90.28 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.373 0.606 . . . . 1.92 110.183 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -59.52 -40.11 86.09 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.888 -0.508 . . . . 3.87 110.369 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.779 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.1 m-20 -63.21 -40.41 97.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 1.35 110.259 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -62.42 -49.63 74.71 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.13 -0.981 . . . . 2.93 112.106 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.933 HG12 ' HB3' ' A' ' 39' ' ' LEU . 26.6 m -64.83 -42.81 95.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.02 -1.05 . . . . 1.07 110.654 -179.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.454 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -62.24 -40.76 97.24 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.39 -0.819 . . . . 0.42 111.689 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 7' ' ' ASN . 73.5 t -60.09 -47.68 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.454 -0.779 . . . . 0.95 111.132 -177.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HG3' HD11 ' A' ' 39' ' ' LEU . 30.0 mm100 -60.61 -48.17 82.95 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 119.245 -0.982 . . . . 1.84 109.553 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -38.6 -56.81 1.97 Allowed Glycine 0 N--CA 1.511 3.688 0 N-CA-C 110.175 -1.17 . . . . 0.36 110.175 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.58 -38.49 91.33 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.977 -0.719 . . . . 1.12 111.004 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 11' ' ' VAL . 93.1 t -59.87 -44.4 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.816 . . . . 0.46 109.427 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.548 HG22 ' CB ' ' A' ' 32' ' ' ALA . 63.9 t -59.98 -44.99 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 108.386 -0.968 . . . . 0.7 108.386 177.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -60.45 -41.57 94.35 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.875 -0.515 . . . . 3.15 111.069 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -64.16 -44.51 91.86 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.345 -0.847 . . . . 2.23 111.445 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.32 -41.96 97.88 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.536 -0.727 . . . . 1.02 111.097 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.463 ' CD ' HG21 ' A' ' 29' ' ' VAL . 39.3 tptt -63.93 -40.02 95.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.361 -0.837 . . . . 2.08 108.993 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.8 67.22 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.58 -0.896 . . . . 0.81 108.58 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 66.0 mttm -84.37 7.38 19.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.729 -0.607 . . . . 2.11 110.852 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 25.9 mmtp 59.28 20.14 8.29 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.172 -0.955 . . . . 2.28 110.938 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.76 162.3 9.6 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.613 -0.68 . . . . 0.71 109.822 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.2 166.48 28.0 Favored 'Trans proline' 0 C--N 1.314 -1.237 0 O-C-N 123.33 1.174 . . . . 0.93 111.133 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.1 -26.87 51.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.747 -0.596 . . . . 2.0 111.005 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.6 -40.04 86.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.478 -0.763 . . . . 2.22 110.557 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.45 -45.93 57.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 1.46 110.933 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.463 HG21 ' CD ' ' A' ' 20' ' ' LYS . 88.8 t -63.89 -49.89 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.498 -0.751 . . . . 0.65 109.461 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -60.0 -44.92 94.24 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.742 -0.599 . . . . 1.33 111.025 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -50.03 75.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.405 -0.809 . . . . 0.46 110.564 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.548 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -63.38 -45.92 88.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.659 -0.651 . . . . 0.39 110.21 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -35.63 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.28 -1.007 . . . . 0.57 108.28 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -59.94 -43.93 94.68 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.45 -0.944 . . . . 2.82 108.45 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? -64.37 -47.44 79.28 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.356 -0.979 . . . . 1.73 108.356 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 tp -59.95 -40.4 88.87 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 115.613 -0.722 . . . . 1.53 110.032 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.6 mt -59.56 -37.41 78.4 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.538 -0.726 . . . . 1.36 109.919 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.7 m -59.84 -40.11 87.42 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.556 -0.715 . . . . 1.31 109.522 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.933 ' HB3' HG12 ' A' ' 9' ' ' VAL . 54.7 mt -63.95 -54.84 28.24 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.036 -0.727 . . . . 0.72 109.036 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.85 -34.65 74.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.565 0.698 . . . . 2.38 109.404 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.454 ' HA ' ' HG2' ' A' ' 44' ' ' LYS . . . -59.88 -38.78 83.19 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.845 -0.535 . . . . 0.69 110.299 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -40.82 84.59 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.24 -0.913 . . . . 1.9 109.884 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -60.39 -45.93 91.8 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.584 -0.698 . . . . 2.03 111.389 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 41' ' ' ALA . 1.0 OUTLIER -61.38 -19.12 61.52 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.327 -0.858 . . . . 2.12 112.034 -178.487 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -59.35 -39.98 84.96 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.365 -0.834 . . . . 2.41 110.745 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.23 -57.42 10.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.575 -0.703 . . . . 2.31 111.092 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.555 ' O ' HG22 ' A' ' 47' ' ' THR . 40.2 m -151.51 19.29 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.236 -0.915 . . . . 2.51 110.776 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.4 39.31 80.68 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.656 -1.378 . . . . 1.86 109.656 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 50' ' ' GLU . 96.6 mm-40 -90.2 -15.39 31.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.606 -0.937 . . . . 2.7 112.2 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' O ' ' A' ' 49' ' ' GLN . 14.8 pt-20 39.75 -176.33 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.608 0 N-CA-C 113.274 0.842 . . . . 2.37 113.274 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.9 t80 . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.944 -1.098 . . . . 2.77 110.724 -179.577 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.6 tp . . . . . 0 N--CA 1.498 1.972 0 CA-C-O 121.505 0.669 . . . . 1.69 109.807 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.75 -46.66 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 C-N-CA 120.441 -0.503 . . . . 1.52 109.872 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -42.51 93.31 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.313 -0.867 . . . . 1.92 109.343 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.495 ' O ' HG22 ' A' ' 9' ' ' VAL . 4.5 t80 -59.89 -39.93 87.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.67 -0.644 . . . . 3.87 110.15 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.733 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.5 m-20 -60.03 -39.98 87.76 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.29 -0.882 . . . . 1.35 110.286 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -59.99 -47.3 86.37 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.689 -0.632 . . . . 2.93 110.892 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.885 ' HA ' HD13 ' A' ' 39' ' ' LEU . 33.1 m -69.12 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.122 -0.986 . . . . 1.07 109.434 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.527 -0.733 . . . . 0.42 110.486 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 7' ' ' ASN . 52.4 t -59.96 -49.04 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.737 -0.602 . . . . 0.95 110.756 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.508 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -60.02 -50.09 75.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.479 -0.763 . . . . 1.84 109.577 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.645 ' HA2' HD13 ' A' ' 36' ' ' LEU . . . -41.93 -55.01 4.23 Favored Glycine 0 N--CA 1.507 3.368 0 N-CA-C 110.49 -1.044 . . . . 0.36 110.49 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -63.34 -35.26 79.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.844 -0.797 . . . . 1.12 111.923 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 11' ' ' VAL . 72.5 t -59.99 -43.58 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.23 -0.919 . . . . 0.46 109.828 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.687 HG11 HG23 ' A' ' 33' ' ' VAL . 62.5 t -59.99 -44.53 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.457 -0.777 . . . . 0.7 109.597 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.675 -0.641 . . . . 3.15 110.806 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.01 -44.03 94.82 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.441 -0.787 . . . . 2.23 111.414 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.495 HD23 ' HB3' ' A' ' 28' ' ' ASP . 4.6 mp -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.328 -0.858 . . . . 1.02 110.337 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.594 ' CD ' HG21 ' A' ' 29' ' ' VAL . 10.7 tptt -62.58 -39.97 95.38 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.196 -0.668 . . . . 2.08 109.196 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.3 -25.48 67.14 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.583 -0.895 . . . . 0.81 108.583 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.29 6.86 24.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.747 -0.596 . . . . 2.11 110.399 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 55.41 25.82 8.11 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.231 -0.918 . . . . 2.28 110.812 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.601 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -58.47 170.33 0.81 Allowed Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.761 -0.587 . . . . 0.71 110.061 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.601 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 45.4 Cg_endo -71.26 154.85 61.42 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.33 1.174 . . . . 0.93 110.012 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -54.47 -24.79 21.78 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.36 -0.837 . . . . 2.0 111.159 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.521 -0.737 . . . . 2.22 110.438 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.495 ' HB3' HD23 ' A' ' 19' ' ' LEU . 68.4 m-20 -72.6 -46.44 54.23 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.457 -0.777 . . . . 1.46 110.974 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.594 HG21 ' CD ' ' A' ' 20' ' ' LYS . 97.8 t -66.04 -49.72 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.648 -0.657 . . . . 0.65 110.608 -179.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.478 ' O ' HG12 ' A' ' 33' ' ' VAL . 75.1 m-20 -59.93 -50.92 71.87 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.388 -0.82 . . . . 1.33 111.625 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.46 90.02 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.038 -1.039 . . . . 0.46 110.399 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.5 ' HB1' HG22 ' A' ' 16' ' ' VAL . . . -65.3 -39.98 93.19 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 120.319 -0.552 . . . . 0.39 110.766 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.687 HG23 HG11 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -68.45 -38.89 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.217 -0.927 . . . . 0.57 109.26 179.594 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -60.0 -35.29 74.72 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.754 0.788 . . . . 2.82 109.113 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -59.95 -40.05 87.66 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.408 0.623 . . . . 1.73 109.587 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.645 HD13 ' HA2' ' A' ' 13' ' ' GLY . 35.3 mt -59.25 -40.03 84.69 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 120.115 -0.634 . . . . 1.53 109.706 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.499 HD12 ' N ' ' A' ' 37' ' ' LEU . 9.7 mp -58.99 -34.67 72.1 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.477 -0.764 . . . . 1.36 109.619 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 26.6 t -59.96 -39.98 87.46 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.903 -0.777 . . . . 1.31 108.903 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.885 HD13 ' HA ' ' A' ' 9' ' ' VAL . 92.2 mt -59.95 -49.98 75.53 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.629 -0.878 . . . . 0.72 108.629 178.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -62.2 -33.03 73.77 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.916 -0.772 . . . . 2.38 108.916 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 38' ' ' SER . . . -60.03 -43.01 95.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.69 109.748 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -61.26 -44.22 97.6 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.231 -1.026 . . . . 1.9 108.231 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.61 -41.2 94.34 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.545 0.688 . . . . 2.03 109.859 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -60.0 -36.35 77.0 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.714 -0.616 . . . . 2.12 111.486 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -56.27 -40.02 73.58 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.322 -0.861 . . . . 2.41 110.745 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.09 -62.83 1.23 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.701 -0.8 . . . . 2.31 110.795 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.2 t -165.78 29.39 0.05 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.303 -0.873 . . . . 2.51 111.613 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.05 63.87 3.42 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 109.136 -1.586 . . . . 1.86 109.136 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 99.6 mt-30 -83.11 -32.15 26.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.656 -0.909 . . . . 2.7 110.462 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 15.2 pt-20 32.31 98.48 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 113.38 0.881 . . . . 2.37 113.38 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.2 p90 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.148 -0.97 . . . . 2.77 110.513 -179.848 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.659 0.742 . . . . 1.69 109.82 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.03 -41.93 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.928 -0.483 . . . . 1.52 111.146 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -59.98 -47.97 83.65 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.317 -0.864 . . . . 1.92 110.149 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.463 ' O ' HG22 ' A' ' 9' ' ' VAL . 8.1 m-85 -57.42 -38.31 74.16 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.522 -0.736 . . . . 3.87 110.418 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.741 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.6 m-20 -60.01 -40.08 88.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.522 -0.736 . . . . 1.35 110.563 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -60.02 -48.89 79.83 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.457 -0.777 . . . . 2.93 110.835 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.848 HG12 ' HB3' ' A' ' 39' ' ' LEU . 30.6 m -65.77 -39.92 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 C-N-CA 119.327 -0.949 . . . . 1.07 109.715 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -40.54 98.06 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.493 -0.754 . . . . 0.42 110.55 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 7' ' ' ASN . 65.8 t -60.66 -42.72 92.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.655 -0.653 . . . . 0.95 110.777 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -62.89 -56.44 17.29 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.132 -0.98 . . . . 1.84 109.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -37.71 -52.74 1.93 Allowed Glycine 0 N--CA 1.512 3.763 0 N-CA-C 110.717 -0.953 . . . . 0.36 110.717 -178.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -61.71 -38.73 88.94 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.976 -0.72 . . . . 1.12 110.941 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 11' ' ' VAL . 97.7 t -59.96 -40.18 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.324 -0.86 . . . . 0.46 110.023 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.416 HG22 ' HB3' ' A' ' 32' ' ' ALA . 71.8 t -60.04 -49.96 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 121.024 -1.047 . . . . 0.7 108.805 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 68.1 ttt-85 -60.07 -44.44 94.75 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 121.459 0.647 . . . . 3.15 110.167 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.14 -48.31 82.26 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.81 -0.556 . . . . 2.23 110.737 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.97 -46.07 90.62 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 120.043 -0.663 . . . . 1.02 110.105 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -66.31 -39.99 89.65 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.414 -0.958 . . . . 2.08 108.414 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.73 -30.55 70.84 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 108.675 -0.861 . . . . 0.81 108.675 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -85.6 10.72 12.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.44 -0.504 . . . . 2.11 110.873 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt 59.91 20.14 9.13 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.302 -0.874 . . . . 2.28 111.195 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -59.4 165.19 4.18 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.554 -0.716 . . . . 0.71 109.953 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 45.3 Cg_endo -70.61 160.55 49.08 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.32 1.168 . . . . 0.93 111.349 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.497 ' HA ' HG12 ' A' ' 29' ' ' VAL . 33.9 mtpt -55.83 -25.71 43.12 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.574 -0.704 . . . . 2.0 110.446 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -59.98 -39.91 87.3 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.152 -0.968 . . . . 2.22 109.953 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -70.0 -49.63 49.57 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.437 -0.789 . . . . 1.46 111.42 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.497 HG12 ' HA ' ' A' ' 26' ' ' LYS . 8.4 p -65.05 -43.25 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.406 -0.809 . . . . 0.65 110.221 -179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.434 ' O ' HG12 ' A' ' 33' ' ' VAL . 95.6 m-20 -60.03 -41.75 92.89 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.8 -0.562 . . . . 1.33 110.792 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.64 -50.11 72.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.447 -0.783 . . . . 0.46 110.797 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -65.46 -41.52 93.3 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 120.182 -0.607 . . . . 0.39 110.331 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.46 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -67.12 -38.87 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 107.412 -1.329 . . . . 0.57 107.412 178.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -60.43 -46.36 90.33 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.342 -0.984 . . . . 2.82 108.342 177.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -64.23 -40.92 97.04 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.095 -1.076 . . . . 1.73 108.095 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.598 ' HA ' HD12 ' A' ' 39' ' ' LEU . 17.2 tp -60.0 -40.33 88.84 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 115.626 -0.715 . . . . 1.53 110.322 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.54 HD23 ' HD3' ' A' ' 40' ' ' LYS . 77.5 mt -59.96 -40.0 87.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.219 -0.926 . . . . 1.36 109.722 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.3 m -60.44 -37.02 79.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.424 -0.798 . . . . 1.31 109.347 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.848 ' HB3' HG12 ' A' ' 9' ' ' VAL . 88.6 mt -59.98 -56.24 24.1 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.672 -0.643 . . . . 0.72 110.439 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.54 ' HD3' HD23 ' A' ' 37' ' ' LEU . 17.6 ptmt -62.11 -35.88 80.06 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.317 -0.865 . . . . 2.38 109.23 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -60.76 -43.77 97.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.112 -0.495 . . . . 0.69 110.488 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.04 -47.6 85.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.111 -0.993 . . . . 1.9 109.259 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.464 ' CE2' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -61.22 -38.7 87.54 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.498 -0.751 . . . . 2.03 109.042 178.081 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.8 ttpt -60.34 -27.27 67.23 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.749 -0.594 . . . . 2.12 111.081 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -55.6 -37.76 68.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.26 -0.9 . . . . 2.41 110.961 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -62.82 -77.71 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.443 -0.786 . . . . 2.31 110.014 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 t -161.49 40.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.31 -0.869 . . . . 2.51 110.241 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.71 65.75 2.4 Favored Glycine 0 N--CA 1.496 2.698 0 N-CA-C 109.972 -1.251 . . . . 1.86 109.972 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HB3' ' CE2' ' A' ' 43' ' ' TYR . 81.6 mm-40 -86.43 -21.75 26.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.467 -1.019 . . . . 2.7 111.608 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 9.0 pt-20 32.21 92.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 112.811 0.671 . . . . 2.37 112.811 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.2 p90 . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.126 -0.984 . . . . 2.77 110.716 -179.217 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.509 HD23 ' C ' ' A' ' 3' ' ' LEU . 7.9 tt . . . . . 0 N--CA 1.502 2.153 0 N-CA-C 112.474 0.546 . . . . 1.69 112.474 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 5' ' ' LEU . 14.7 p -58.64 -39.5 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.089 -1.007 . . . . 1.52 110.251 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.612 HD12 ' CZ ' ' A' ' 43' ' ' TYR . 0.5 OUTLIER -58.93 -39.96 83.18 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 109.394 -0.595 . . . . 1.92 109.394 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.56 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 m-85 -59.11 -38.26 79.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.614 -0.679 . . . . 3.87 110.103 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.836 ' O ' HG23 ' A' ' 11' ' ' VAL . 58.9 m-20 -60.04 -40.75 90.48 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.14 -0.975 . . . . 1.35 109.938 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -60.01 -49.52 77.32 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.762 -0.586 . . . . 2.93 110.715 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.861 HG12 ' HB3' ' A' ' 39' ' ' LEU . 26.5 m -66.76 -39.46 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.391 -0.818 . . . . 1.07 109.565 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 51' ' ' TYR . . . -60.51 -37.1 80.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.534 -0.728 . . . . 0.42 110.319 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.836 HG23 ' O ' ' A' ' 7' ' ' ASN . 64.2 t -60.01 -49.95 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.625 -0.672 . . . . 0.95 109.76 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.37 -56.13 21.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.353 -0.842 . . . . 1.84 109.876 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -36.42 -52.5 1.35 Allowed Glycine 0 N--CA 1.514 3.866 0 N-CA-C 110.907 -0.877 . . . . 0.36 110.907 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -62.26 -37.93 87.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.884 -0.774 . . . . 1.12 111.289 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 11' ' ' VAL . 76.2 t -59.52 -40.56 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.329 -0.857 . . . . 0.46 109.469 -178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.1 t -59.98 -49.6 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.4 -0.812 . . . . 0.7 109.004 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -60.0 -43.48 95.19 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.581 -0.699 . . . . 3.15 110.423 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -60.4 -39.5 87.57 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.481 -0.762 . . . . 2.23 111.255 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 28' ' ' ASP . 83.1 mt -60.02 -40.5 89.54 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.374 -0.829 . . . . 1.02 110.924 -178.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.522 ' HE2' HG21 ' A' ' 29' ' ' VAL . 14.3 mmtp -66.24 -40.26 90.1 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.35 -0.844 . . . . 2.08 109.326 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.39 66.93 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.171 -1.048 . . . . 0.81 108.171 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 48.7 mtpt -86.33 9.44 17.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.715 -0.616 . . . . 2.11 111.007 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 57.9 mtpt 58.08 24.77 11.6 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.28 -0.888 . . . . 2.28 110.822 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 157.99 40.65 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.777 -0.577 . . . . 0.71 110.3 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.52 167.44 27.03 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.433 1.228 . . . . 0.93 110.478 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -56.63 -31.86 64.76 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.732 -0.605 . . . . 2.0 109.778 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -59.71 -40.05 86.66 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.637 -0.664 . . . . 2.22 110.533 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.478 ' HB3' HD22 ' A' ' 19' ' ' LEU . 63.1 m-20 -69.81 -42.45 73.69 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.291 -0.881 . . . . 1.46 110.049 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.522 HG21 ' HE2' ' A' ' 20' ' ' LYS . 93.8 t -67.68 -48.95 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 CA-C-O 121.39 0.614 . . . . 0.65 109.773 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.427 ' O ' HG12 ' A' ' 33' ' ' VAL . 89.1 m-20 -59.92 -46.87 87.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.658 -0.652 . . . . 1.33 111.198 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.29 -47.72 84.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.333 -0.855 . . . . 0.46 110.758 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.75 -44.99 88.32 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.497 -0.752 . . . . 0.39 110.247 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.444 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -64.47 -38.51 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.031 -1.1 . . . . 0.57 108.031 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.06 -45.5 92.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 108.07 -1.085 . . . . 2.82 108.07 177.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -63.57 -43.15 97.84 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 122.117 0.961 . . . . 1.73 108.604 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 17.4 tp -59.96 -42.44 94.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.833 -0.621 . . . . 1.53 110.096 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.03 -38.72 83.55 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.499 -0.75 . . . . 1.36 110.384 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 p -59.98 -37.57 80.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.365 -0.835 . . . . 1.31 109.337 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.861 ' HB3' HG12 ' A' ' 9' ' ' VAL . 79.7 mt -62.23 -52.93 61.8 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.609 -0.886 . . . . 0.72 108.609 178.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.58 -38.37 84.37 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.42 0.629 . . . . 2.38 109.361 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.39 93.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.757 -0.59 . . . . 0.69 109.762 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -60.08 -44.9 94.43 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.617 -0.882 . . . . 1.9 108.617 178.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.612 ' CZ ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -60.19 -43.34 95.98 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.433 0.635 . . . . 2.03 110.101 178.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.54 -29.03 68.88 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.722 -0.611 . . . . 2.12 111.793 -179.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -55.97 -39.97 72.58 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.288 -0.882 . . . . 2.41 111.212 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.31 -64.39 0.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.397 -0.815 . . . . 2.31 110.79 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -165.94 32.79 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.383 -0.823 . . . . 2.51 110.994 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.59 70.58 1.2 Allowed Glycine 0 N--CA 1.498 2.788 0 N-CA-C 110.398 -1.081 . . . . 1.86 110.398 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 50' ' ' GLU . 60.6 mm-40 -85.92 -28.01 24.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.537 -0.978 . . . . 2.7 110.405 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.492 ' O ' ' O ' ' A' ' 49' ' ' GLN . 16.2 pt-20 39.47 114.98 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 122.892 1.33 . . . . 2.37 113.088 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.572 ' CD1' HG23 ' A' ' 9' ' ' VAL . 13.9 t80 . . . . . 0 N--CA 1.498 1.949 0 O-C-N 120.844 -1.16 . . . . 2.77 110.668 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 37.5 tp . . . . . 0 N--CA 1.499 1.98 0 CA-C-O 121.123 0.487 . . . . 1.69 110.845 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 5' ' ' LEU . 11.9 p -59.56 -46.36 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.59 -0.694 . . . . 1.52 110.904 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.493 ' N ' HG13 ' A' ' 4' ' ' VAL . 85.0 mt -61.38 -40.03 92.83 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.346 -0.846 . . . . 1.92 109.404 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.492 ' O ' HG22 ' A' ' 9' ' ' VAL . 32.3 t80 -59.93 -39.85 86.93 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.045 -0.724 . . . . 3.87 109.045 178.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.832 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.6 m-20 -60.14 -39.88 87.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.408 -0.807 . . . . 1.35 109.995 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -58.94 -49.97 75.82 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.382 -0.824 . . . . 2.93 110.431 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.861 HG12 ' HB3' ' A' ' 39' ' ' LEU . 28.0 m -68.43 -38.19 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.156 -0.965 . . . . 1.07 108.626 178.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -38.15 81.71 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.745 -0.597 . . . . 0.42 110.346 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.5 t -60.03 -50.38 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.678 -0.639 . . . . 0.95 110.78 -178.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.86 ' HG3' HD11 ' A' ' 39' ' ' LEU . 29.5 mm100 -61.72 -49.24 77.26 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.202 -0.999 . . . . 1.84 109.923 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -45.04 -48.65 9.65 Favored Glycine 0 N--CA 1.506 3.333 0 N-CA-C 109.561 -1.415 . . . . 0.36 109.561 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -64.04 -35.99 82.52 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.889 -0.771 . . . . 1.12 110.742 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 11' ' ' VAL . 69.4 t -59.01 -40.05 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.414 -0.804 . . . . 0.46 109.809 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.705 HG13 HG13 ' A' ' 29' ' ' VAL . 59.1 t -59.98 -49.72 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 108.247 -1.019 . . . . 0.7 108.247 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -60.04 -45.34 93.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.696 -0.627 . . . . 3.15 110.211 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.94 -40.04 91.75 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.62 -0.675 . . . . 2.23 111.063 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 71.9 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.433 -0.792 . . . . 1.02 110.685 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.738 ' HE3' HG11 ' A' ' 29' ' ' VAL . 13.6 mmtp -63.37 -40.06 96.23 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.164 -0.68 . . . . 2.08 109.164 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.55 -26.39 68.68 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.522 -0.918 . . . . 0.81 108.522 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 76.5 mttt -86.03 8.73 19.49 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.791 -0.568 . . . . 2.11 110.629 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 48.3 mttp 59.31 20.03 8.22 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.308 -0.87 . . . . 2.28 110.545 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.58 155.9 56.97 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.59 -0.694 . . . . 0.71 110.013 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.45 160.36 50.08 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.434 1.229 . . . . 0.93 110.454 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -55.05 -26.49 37.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.498 -0.751 . . . . 2.0 110.53 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -59.95 -40.01 87.52 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.577 -0.702 . . . . 2.22 110.898 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -69.86 -43.12 72.52 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.404 -0.81 . . . . 1.46 111.023 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.738 HG11 ' HE3' ' A' ' 20' ' ' LYS . 90.4 t -68.02 -43.79 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.65 110.287 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.492 ' O ' HG12 ' A' ' 33' ' ' VAL . 85.3 m-20 -59.99 -43.52 95.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -0.754 . . . . 1.33 111.322 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.66 83.96 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.378 -0.826 . . . . 0.46 110.928 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.48 -40.14 95.11 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 120.006 -0.677 . . . . 0.39 110.686 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -68.17 -39.96 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 119.487 -0.885 . . . . 0.57 108.881 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -60.44 -40.95 92.97 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.198 -1.038 . . . . 2.82 108.198 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.3 -39.57 93.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.303 -0.999 . . . . 1.73 108.303 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.901 HD22 HD12 ' A' ' 39' ' ' LEU . 1.6 tm? -57.88 -40.01 79.21 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 116.033 -0.53 . . . . 1.53 109.851 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mp -56.77 -39.11 73.46 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.172 -0.955 . . . . 1.36 109.005 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.4 t -59.96 -39.65 86.34 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.87 -0.789 . . . . 1.31 108.87 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.901 HD12 HD22 ' A' ' 36' ' ' LEU . 82.7 mt -64.31 -39.8 94.63 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.935 -0.765 . . . . 0.72 108.935 179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -59.25 -37.37 77.44 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.805 -0.559 . . . . 2.38 109.593 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.95 -39.99 87.46 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.585 -0.697 . . . . 0.69 109.799 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.53 -41.77 92.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.298 -0.876 . . . . 1.9 109.614 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -60.01 -47.24 86.63 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.653 -0.655 . . . . 2.03 111.782 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.499 ' CB ' ' HA ' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -55.67 -28.75 57.2 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.562 -0.711 . . . . 2.12 111.614 -177.037 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.468 ' N ' ' HG3' ' A' ' 44' ' ' LYS . 58.1 mm-40 -60.02 -39.93 87.58 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.256 -0.903 . . . . 2.41 110.5 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -63.31 -52.78 60.5 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.513 -0.742 . . . . 2.31 112.238 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 m -156.37 -70.92 0.11 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.011 -1.056 . . . . 2.51 112.767 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -86.63 -113.83 0.91 Allowed Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.926 -1.13 . . . . 1.86 113.2 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.499 ' HA ' ' CB ' ' A' ' 44' ' ' LYS . 32.9 mt-30 -140.98 -30.26 0.64 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.994 -0.71 . . . . 2.7 112.87 -176.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -158.02 155.74 29.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.086 -1.009 . . . . 2.37 111.425 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.445 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 51.7 p90 . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.693 -0.629 . . . . 2.77 110.454 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 120.706 0.289 . . . . 1.69 110.511 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 84.5 t -59.93 -49.79 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.201 -0.937 . . . . 1.52 109.094 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.04 -38.12 81.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.639 -0.663 . . . . 1.92 109.927 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -59.98 -40.0 87.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.599 -0.688 . . . . 3.87 110.127 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 11' ' ' VAL . 73.6 m-20 -60.02 -39.64 86.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.499 -0.751 . . . . 1.35 110.23 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -59.97 -51.11 71.07 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.38 -0.825 . . . . 2.93 110.534 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.603 HG22 ' CD2' ' A' ' 51' ' ' TYR . 8.3 p -69.04 -42.5 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.452 -0.78 . . . . 1.07 109.785 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.416 ' N ' HG13 ' A' ' 9' ' ' VAL . . . -60.05 -47.61 85.15 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.543 -0.723 . . . . 0.42 111.269 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.633 ' O ' HG23 ' A' ' 15' ' ' VAL . 56.1 t -60.02 -48.13 89.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.61 -0.681 . . . . 0.95 110.732 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.24 -55.17 31.02 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.194 -0.941 . . . . 1.84 109.709 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.94 -55.02 2.92 Favored Glycine 0 N--CA 1.508 3.445 0 N-CA-C 111.095 -0.802 . . . . 0.36 111.095 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -63.87 -38.46 91.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.75 -0.853 . . . . 1.12 111.377 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 11' ' ' VAL . 72.6 t -59.46 -40.05 80.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.459 -0.776 . . . . 0.46 109.683 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.538 HG22 ' HB3' ' A' ' 32' ' ' ALA . 54.5 t -59.96 -50.05 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.271 -0.893 . . . . 0.7 108.67 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.6 ttp85 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.604 -0.685 . . . . 3.15 109.967 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -60.11 -45.14 93.96 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.626 -0.671 . . . . 2.23 110.442 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.95 -40.09 87.8 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.401 0.62 . . . . 1.02 110.088 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.694 ' HD2' HG21 ' A' ' 29' ' ' VAL . 2.4 tptm -63.33 -40.15 96.53 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.018 -0.734 . . . . 2.08 109.018 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.44 -27.81 68.78 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.214 -1.032 . . . . 0.81 108.214 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 59.5 mtpt -86.37 9.11 18.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.765 -0.585 . . . . 2.11 110.904 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 56.1 mttm 59.32 22.11 10.44 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.28 -0.887 . . . . 2.28 110.9 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.27 161.09 10.6 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.603 -0.686 . . . . 0.71 110.397 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.12 158.3 52.42 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.462 1.243 . . . . 0.93 110.143 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -55.48 -28.06 52.21 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.501 -0.75 . . . . 2.0 110.448 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -59.33 -41.63 89.56 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.624 -0.672 . . . . 2.22 110.352 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -70.5 -42.78 70.89 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.489 -0.757 . . . . 1.46 110.37 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.694 HG21 ' HD2' ' A' ' 20' ' ' LYS . 65.7 t -68.86 -49.39 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.726 -0.609 . . . . 0.65 110.522 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.416 ' O ' HG12 ' A' ' 33' ' ' VAL . 99.6 m-20 -60.08 -43.23 95.64 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.433 -0.792 . . . . 1.33 111.491 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -49.99 75.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.308 -0.87 . . . . 0.46 110.707 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.538 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -65.32 -41.57 93.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.188 -0.605 . . . . 0.39 110.548 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.416 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.09 -38.44 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 108.262 -1.014 . . . . 0.57 108.262 179.357 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -60.82 -41.21 95.28 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.687 -0.857 . . . . 2.82 108.687 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.1 tp60 -64.69 -41.93 95.68 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.221 -1.029 . . . . 1.73 108.221 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.601 HD13 ' C ' ' A' ' 36' ' ' LEU . 3.1 tm? -60.01 -41.18 91.59 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 116.065 -0.516 . . . . 1.53 110.093 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.9 mt -59.6 -40.01 86.06 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.409 -0.807 . . . . 1.36 109.946 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.6 m -60.08 -39.99 88.01 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.593 -0.692 . . . . 1.31 109.255 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.1 -46.5 80.82 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.453 -0.943 . . . . 0.72 108.453 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -60.04 -40.98 91.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.926 -0.484 . . . . 2.38 110.348 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.05 -40.44 97.7 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.527 -0.733 . . . . 0.69 110.285 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -66.76 -39.98 88.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.52 -0.737 . . . . 1.9 110.037 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -43.62 95.14 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.542 -0.724 . . . . 2.03 109.952 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -63.71 -27.6 69.32 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.668 -0.645 . . . . 2.12 111.81 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -39.57 69.3 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.151 -0.968 . . . . 2.41 110.911 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -62.24 -58.41 7.85 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.568 -0.708 . . . . 2.31 110.276 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.475 HG23 ' HG3' ' A' ' 49' ' ' GLN . 4.4 t -161.43 29.57 0.13 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.461 -0.774 . . . . 2.51 110.377 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.46 47.64 27.37 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.526 -1.03 . . . . 1.86 110.526 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.475 ' HG3' HG23 ' A' ' 47' ' ' THR . 99.5 mt-30 -85.71 -11.43 53.71 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.356 -1.085 . . . . 2.7 111.163 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 35.97 -157.76 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.689 0 N-CA-C 112.519 0.562 . . . . 2.37 112.519 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.603 ' CD2' HG22 ' A' ' 9' ' ' VAL . 33.4 t80 . . . . . 0 N--CA 1.495 1.819 0 O-C-N 121.275 -0.891 . . . . 2.77 109.919 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.609 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 120.639 0.257 . . . . 1.69 111.197 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.566 HG23 HD12 ' A' ' 5' ' ' LEU . 29.6 m -54.93 -43.42 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.212 -0.93 . . . . 1.52 110.622 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.566 HD12 HG23 ' A' ' 4' ' ' VAL . 2.3 mp -60.9 -40.1 91.81 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.453 -0.779 . . . . 1.92 109.69 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.496 ' O ' HG22 ' A' ' 9' ' ' VAL . 5.4 t80 -59.66 -39.37 84.2 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.542 0.687 . . . . 3.87 110.028 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.746 ' O ' HG23 ' A' ' 11' ' ' VAL . 24.6 m120 -59.97 -39.34 85.32 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.756 . . . . 1.35 110.048 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.4 mmm-85 -60.01 -49.91 75.8 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.768 . . . . 2.93 110.519 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.763 HG12 ' HB3' ' A' ' 39' ' ' LEU . 32.9 m -67.19 -40.07 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 C-N-CA 119.235 -0.986 . . . . 1.07 108.417 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.96 93.2 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.756 -0.59 . . . . 0.42 111.437 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 7' ' ' ASN . 39.6 t -59.99 -52.16 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.481 -0.762 . . . . 0.95 111.411 -178.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.492 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 96.5 mm-40 -60.17 -47.28 86.6 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.242 -0.911 . . . . 1.84 110.477 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.516 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -41.54 -52.59 4.47 Favored Glycine 0 N--CA 1.509 3.531 0 N-CA-C 109.936 -1.266 . . . . 0.36 109.936 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -65.97 -37.04 84.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 122.122 -0.634 . . . . 1.12 111.256 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 11' ' ' VAL . 93.3 t -60.02 -40.31 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.315 -0.866 . . . . 0.46 109.689 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.04 -49.91 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 108.878 -0.786 . . . . 0.7 108.878 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.57 -43.0 97.77 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.612 -0.68 . . . . 3.15 110.784 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -61.63 -44.24 97.36 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.408 -0.807 . . . . 2.23 111.084 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 85.9 mt -60.04 -39.97 87.76 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.427 0.632 . . . . 1.02 110.464 -179.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -65.98 -39.99 90.83 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.253 0.549 . . . . 2.08 109.571 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.55 66.85 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 108.918 -0.771 . . . . 0.81 108.918 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' HE2' ' HA ' ' A' ' 19' ' ' LEU . 9.1 mtmt -86.69 10.14 16.64 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.614 -0.835 . . . . 2.11 111.001 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 58.85 21.99 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.228 -0.92 . . . . 2.28 110.812 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.498 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -58.68 160.33 10.63 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.516 -0.74 . . . . 0.71 109.944 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.38 167.77 26.37 Favored 'Trans proline' 0 C--N 1.316 -1.168 0 O-C-N 123.359 1.189 . . . . 0.93 109.838 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -53.92 -22.65 10.6 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.544 -0.722 . . . . 2.0 110.364 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -55.74 -45.71 77.94 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.54 -0.725 . . . . 2.22 110.27 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.498 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 98.2 m-20 -72.22 -40.9 67.46 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.546 -0.721 . . . . 1.46 111.113 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 55.9 t -68.29 -47.61 77.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.488 -0.758 . . . . 0.65 110.214 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.446 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.8 m-20 -59.94 -46.43 89.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.715 . . . . 1.33 110.951 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.47 -49.96 73.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.406 -0.809 . . . . 0.46 110.649 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.58 -42.47 95.6 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.042 -0.663 . . . . 0.39 110.358 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -67.64 -37.84 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.465 -0.939 . . . . 0.57 108.465 179.445 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 37' ' ' LEU . 85.5 tttt -59.97 -37.87 80.86 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.902 0.858 . . . . 2.82 108.881 178.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -60.0 -41.56 92.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.936 -0.477 . . . . 1.73 109.761 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.516 HD11 ' HA2' ' A' ' 13' ' ' GLY . 22.6 mt -59.15 -39.97 84.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.837 -0.539 . . . . 1.53 110.771 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 34' ' ' LYS . 84.4 mt -58.32 -40.58 82.45 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.519 -0.738 . . . . 1.36 110.032 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.5 m -62.35 -39.99 94.94 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.744 -0.783 . . . . 1.31 109.644 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HG12 ' A' ' 9' ' ' VAL . 25.6 mt -66.9 -51.49 54.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.644 . . . . 0.72 109.379 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -60.72 -39.96 90.54 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.753 -0.592 . . . . 2.38 109.735 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.1 -42.51 94.82 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.885 -0.509 . . . . 0.69 111.042 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -70.03 -43.15 71.88 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.324 -0.86 . . . . 1.9 110.749 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.429 ' CD1' ' CB ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -62.02 -49.02 77.69 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 2.03 112.352 -179.335 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -59.7 -23.16 62.9 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.225 -0.922 . . . . 2.12 111.429 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -60.04 -39.99 87.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.418 -0.801 . . . . 2.41 110.807 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.99 -60.06 2.79 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.374 -0.93 . . . . 2.31 110.561 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.545 HG22 ' O ' ' A' ' 47' ' ' THR . 32.7 m -160.18 45.29 0.22 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.148 -0.97 . . . . 2.51 111.868 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.38 42.08 96.17 Favored Glycine 0 N--CA 1.5 2.911 0 N-CA-C 109.073 -1.611 . . . . 1.86 109.073 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.429 ' CB ' ' CD1' ' A' ' 43' ' ' TYR . 93.8 mt-30 -96.76 28.35 3.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.703 -0.88 . . . . 2.7 110.939 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -52.41 178.44 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.712 -0.617 . . . . 2.37 110.849 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.1 t80 . . . . . 0 N--CA 1.5 2.059 0 O-C-N 121.541 -0.724 . . . . 2.77 111.519 -178.351 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.8 tp . . . . . 0 N--CA 1.499 2.019 0 CA-C-O 121.4 0.619 . . . . 1.69 109.872 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.4 t -59.82 -41.06 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.88 -0.513 . . . . 1.52 110.421 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 mt -60.01 -43.5 95.19 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.251 -0.906 . . . . 1.92 109.843 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.02 -39.11 84.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.611 -0.68 . . . . 3.87 109.75 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.734 ' O ' HG13 ' A' ' 11' ' ' VAL . 30.8 m120 -60.99 -40.64 94.27 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 1.35 110.719 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.7 -50.39 73.67 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.298 -0.876 . . . . 2.93 110.956 -179.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.763 HG12 ' HB3' ' A' ' 39' ' ' LEU . 17.5 m -70.14 -40.57 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 1.07 108.472 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.438 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.84 -50.54 73.01 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 112.89 0.7 . . . . 0.42 112.89 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.734 HG13 ' O ' ' A' ' 7' ' ' ASN . 32.8 m -60.2 -45.2 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.169 -0.957 . . . . 0.95 111.827 -177.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.53 ' HG3' HD11 ' A' ' 39' ' ' LEU . 29.5 mm100 -60.15 -50.39 73.88 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.049 -1.032 . . . . 1.84 110.372 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.606 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -45.79 -41.69 10.34 Favored Glycine 0 N--CA 1.507 3.372 0 N-CA-C 109.302 -1.519 . . . . 0.36 109.302 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -66.16 -37.44 85.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 122.097 -0.649 . . . . 1.12 110.908 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.1 t -60.01 -40.87 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.53 -0.731 . . . . 0.46 110.012 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.453 HG22 ' CB ' ' A' ' 32' ' ' ALA . 61.5 t -60.69 -46.36 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.281 -0.887 . . . . 0.7 109.045 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -59.95 -40.06 87.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.571 -0.705 . . . . 3.15 110.654 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -59.99 -42.82 95.06 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.546 -0.721 . . . . 2.23 110.059 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.03 -40.03 87.92 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.752 -0.592 . . . . 1.02 110.577 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.582 ' HE2' HG11 ' A' ' 29' ' ' VAL . 46.8 mmtt -60.63 -44.19 96.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.33 -0.856 . . . . 2.08 109.093 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.26 68.55 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.312 -0.996 . . . . 0.81 108.312 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -85.48 8.21 19.95 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.761 -0.587 . . . . 2.11 110.764 179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt 58.46 21.61 8.67 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.242 -0.911 . . . . 2.28 110.755 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.61 148.68 80.91 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.633 -0.667 . . . . 0.71 110.183 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -70.36 168.2 23.03 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.418 1.22 . . . . 0.93 110.898 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.3 mmmt -55.92 -30.74 62.1 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.811 -0.555 . . . . 2.0 110.84 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -59.09 -40.02 83.98 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.498 -0.751 . . . . 2.22 110.532 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -71.48 -44.07 65.43 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.433 -0.792 . . . . 1.46 110.478 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.582 HG11 ' HE2' ' A' ' 20' ' ' LYS . 94.2 t -69.08 -40.58 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.69 -0.631 . . . . 0.65 110.328 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.454 ' O ' HG12 ' A' ' 33' ' ' VAL . 87.3 m-20 -59.27 -47.84 83.86 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.334 -0.853 . . . . 1.33 111.084 -179.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.71 -49.67 75.53 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.114 -0.991 . . . . 0.46 110.651 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.453 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -66.21 -40.14 90.13 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.691 -0.63 . . . . 0.39 110.879 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.454 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.19 -38.37 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 108.516 -0.92 . . . . 0.57 108.516 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 30' ' ' ASP . 64.0 mmtt -60.49 -40.0 89.74 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.527 -0.733 . . . . 2.82 109.197 177.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -61.23 -53.07 61.51 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.704 -0.623 . . . . 1.73 109.666 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.606 HD22 ' HA2' ' A' ' 13' ' ' GLY . 0.1 OUTLIER -60.16 -40.09 88.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.657 -0.652 . . . . 1.53 109.644 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.06 -39.97 87.84 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.391 -0.818 . . . . 1.36 109.583 179.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -59.99 -39.47 85.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 1.31 109.391 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HG12 ' A' ' 9' ' ' VAL . 93.6 mt -59.96 -55.21 36.86 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.618 -0.676 . . . . 0.72 110.581 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.7 pttp -65.77 -29.96 70.54 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.175 -0.953 . . . . 2.38 109.428 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.59 92.52 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.295 -0.562 . . . . 0.69 109.645 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -63.83 -44.64 92.63 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.233 -1.025 . . . . 1.9 108.233 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -60.42 -41.65 94.4 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.623 0.725 . . . . 2.03 109.836 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.98 -39.75 86.79 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.829 -0.545 . . . . 2.12 111.237 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -55.68 -40.01 71.73 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.347 -0.846 . . . . 2.41 111.187 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -63.71 -85.01 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.234 -0.916 . . . . 2.31 110.623 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.4 t -159.97 51.75 0.33 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.014 -1.054 . . . . 2.51 111.705 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.28 41.22 69.11 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.616 -0.994 . . . . 1.86 110.616 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -95.56 23.18 6.27 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.47 -1.017 . . . . 2.7 111.048 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.9 141.18 55.94 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.592 0.711 . . . . 2.37 110.236 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.49 ' CD2' HG21 ' A' ' 9' ' ' VAL . 55.6 p90 . . . . . 0 N--CA 1.499 1.986 0 CA-C-O 121.502 0.668 . . . . 2.77 111.452 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.3 tp . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 120.94 0.4 . . . . 1.69 110.556 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.461 HG13 ' N ' ' A' ' 5' ' ' LEU . 7.8 p -55.27 -43.48 71.15 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.417 -0.802 . . . . 1.52 110.48 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.461 ' N ' HG13 ' A' ' 4' ' ' VAL . 81.1 mt -60.2 -40.0 88.56 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.637 -0.664 . . . . 1.92 109.428 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.415 ' O ' HG22 ' A' ' 9' ' ' VAL . 0.3 OUTLIER -57.03 -47.58 80.57 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-O 121.488 0.661 . . . . 3.87 109.599 179.346 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.572 ' O ' HG13 ' A' ' 11' ' ' VAL . 78.3 m-20 -62.43 -40.07 95.36 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.622 -0.674 . . . . 1.35 110.799 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.74 ' HG2' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -59.97 -49.89 75.88 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.408 -0.808 . . . . 2.93 110.647 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.79 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.03 -40.0 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 1.07 109.23 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -59.97 -49.74 76.48 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.79 0.663 . . . . 0.42 112.79 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.825 ' O ' HG23 ' A' ' 15' ' ' VAL . 34.2 m -59.88 -45.38 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.172 -0.955 . . . . 0.95 111.037 -177.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.486 ' HG3' HD11 ' A' ' 39' ' ' LEU . 27.2 mm100 -60.93 -49.46 77.37 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.106 -0.996 . . . . 1.84 109.673 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.53 -58.85 2.04 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.408 -1.077 . . . . 0.36 110.408 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -63.64 -36.29 83.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.835 -0.803 . . . . 1.12 111.028 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.825 HG23 ' O ' ' A' ' 11' ' ' VAL . 90.1 t -60.01 -40.48 83.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.332 -0.855 . . . . 0.46 109.579 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 32' ' ' ALA . 66.5 t -60.2 -50.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.394 -0.816 . . . . 0.7 109.235 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -62.56 -42.95 99.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.65 -0.657 . . . . 3.15 111.244 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.96 -44.44 94.43 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.557 -0.714 . . . . 2.23 110.722 -178.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.4 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.822 -0.549 . . . . 1.02 110.904 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.667 ' HD3' HG21 ' A' ' 29' ' ' VAL . 12.2 tptt -65.99 -40.05 90.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.646 -0.659 . . . . 2.08 109.383 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.58 -26.99 67.36 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.841 -0.8 . . . . 0.81 108.841 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 98.3 mttt -86.17 9.13 18.39 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.058 -0.657 . . . . 2.11 110.509 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 84.6 mttt 58.97 19.94 7.68 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.377 -0.827 . . . . 2.28 110.968 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.596 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -58.94 167.58 1.88 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.57 -0.706 . . . . 0.71 109.734 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.489 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 51.4 Cg_endo -73.61 163.99 36.03 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 O-C-N 123.355 1.187 . . . . 0.93 110.107 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mttp -54.59 -23.55 17.38 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.473 -0.767 . . . . 2.0 109.594 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -56.71 -40.57 75.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.704 -0.623 . . . . 2.22 110.383 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.596 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 86.6 m-20 -73.22 -42.27 62.82 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.545 -0.722 . . . . 1.46 111.023 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.667 HG21 ' HD3' ' A' ' 20' ' ' LYS . 62.5 t -69.94 -54.04 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.538 -0.726 . . . . 0.65 110.963 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -60.21 -41.02 92.13 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.43 -0.794 . . . . 1.33 112.101 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.95 75.41 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.241 -0.912 . . . . 0.46 110.9 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.569 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -66.43 -41.41 89.23 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 119.938 -0.705 . . . . 0.39 110.192 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.403 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -66.63 -39.03 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.044 -1.095 . . . . 0.57 108.044 178.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -60.26 -43.74 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.179 -1.045 . . . . 2.82 108.179 177.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -65.81 -45.81 80.96 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.562 -0.903 . . . . 1.73 108.562 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.403 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 7.9 tp -59.69 -39.95 86.28 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 109.749 -0.463 . . . . 1.53 109.749 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -58.9 -39.99 83.13 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.369 -0.832 . . . . 1.36 109.512 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -61.53 -41.53 97.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 1.31 109.137 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.79 ' HB3' HG12 ' A' ' 9' ' ' VAL . 71.6 mt -62.57 -49.93 73.33 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.818 -0.808 . . . . 0.72 108.818 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -60.06 -40.02 88.03 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.56 0.695 . . . . 2.38 109.231 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.7 -44.27 96.78 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.951 -0.468 . . . . 0.69 110.649 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.01 -47.17 86.95 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.248 -0.907 . . . . 1.9 109.594 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -42.74 94.79 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.918 0.866 . . . . 2.03 109.466 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -60.62 -40.03 90.4 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.942 -0.572 . . . . 2.12 112.137 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.44 -39.95 85.22 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.288 -0.882 . . . . 2.41 111.595 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -61.53 -51.26 69.32 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.291 -0.881 . . . . 2.31 111.462 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 47' ' ' THR . 82.4 m -157.91 16.13 0.23 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.27 -0.894 . . . . 2.51 112.093 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.03 37.74 73.67 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.074 -1.21 . . . . 1.86 110.074 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.47 ' O ' ' O ' ' A' ' 50' ' ' GLU . 97.9 mt-30 -84.73 -24.06 29.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.487 -1.008 . . . . 2.7 110.714 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 49' ' ' GLN . 13.3 pt-20 40.91 175.18 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.628 0 CA-C-O 122.57 1.176 . . . . 2.37 113.924 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.425 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.6 t80 . . . . . 0 N--CA 1.5 2.054 0 O-C-N 121.149 -0.969 . . . . 2.77 110.982 -179.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 120.691 0.281 . . . . 1.69 110.736 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.468 HG23 ' N ' ' A' ' 5' ' ' LEU . 35.7 m -55.62 -42.07 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.349 -0.845 . . . . 1.52 110.385 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.468 ' N ' HG23 ' A' ' 4' ' ' VAL . 68.6 mt -60.47 -41.43 94.18 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.499 -0.751 . . . . 1.92 109.603 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -42.8 78.51 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.8 -0.563 . . . . 3.87 110.129 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.612 ' O ' HG23 ' A' ' 11' ' ' VAL . 28.9 m120 -59.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.574 -0.704 . . . . 1.35 111.509 -179.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -60.08 -56.32 23.05 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.178 -0.951 . . . . 2.93 110.378 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.607 HG21 ' CD1' ' A' ' 51' ' ' TYR . 8.6 p -69.32 -38.03 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.401 -0.812 . . . . 1.07 110.128 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -46.43 89.49 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.57 -0.706 . . . . 0.42 111.557 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 7' ' ' ASN . 63.6 t -59.98 -47.96 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.548 -0.72 . . . . 0.95 110.383 -178.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.487 ' O ' HG12 ' A' ' 15' ' ' VAL . 6.7 tp-100 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.359 -0.838 . . . . 1.84 109.97 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -42.6 -48.53 5.93 Favored Glycine 0 N--CA 1.508 3.48 0 N-CA-C 110.181 -1.168 . . . . 0.36 110.181 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -62.89 -37.36 86.63 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.999 -0.707 . . . . 1.12 111.464 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.487 HG12 ' O ' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -59.21 -39.24 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.156 -0.965 . . . . 0.46 109.702 -179.023 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.48 HG22 ' CB ' ' A' ' 32' ' ' ALA . 54.5 t -59.97 -44.8 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 N-CA-C 108.924 -0.769 . . . . 0.7 108.924 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -59.99 -41.6 92.38 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 3.15 109.868 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.04 -40.1 95.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 2.23 111.18 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.08 -40.0 92.06 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.411 -0.806 . . . . 1.02 110.86 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.504 ' CD ' HG21 ' A' ' 29' ' ' VAL . 12.4 tptm -65.69 -42.31 91.35 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.504 -0.747 . . . . 2.08 109.028 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.82 64.38 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.767 -0.827 . . . . 0.81 108.767 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp -85.95 8.62 19.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.683 -0.636 . . . . 2.11 110.721 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 59.3 20.09 8.27 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.272 -0.892 . . . . 2.28 111.144 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.99 161.76 8.38 Favored Pre-proline 0 N--CA 1.498 1.945 0 O-C-N 121.506 -0.746 . . . . 0.71 110.137 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.39 165.26 32.26 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.485 1.255 . . . . 0.93 110.912 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -57.0 -31.7 65.36 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.672 -0.642 . . . . 2.0 110.673 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.64 -40.02 82.23 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.571 -0.705 . . . . 2.22 110.507 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -70.13 -41.45 73.89 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.637 -0.664 . . . . 1.46 110.77 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.504 HG21 ' CD ' ' A' ' 20' ' ' LYS . 99.8 t -66.93 -51.27 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.566 -0.709 . . . . 0.65 109.751 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.3 m-20 -60.02 -45.6 92.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.758 -0.589 . . . . 1.33 110.758 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.46 75.39 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.311 -0.868 . . . . 0.46 110.36 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.48 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -63.34 -43.5 97.56 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.139 -0.624 . . . . 0.39 110.628 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.656 ' HA ' HD23 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -65.63 -37.34 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 119.456 -0.898 . . . . 0.57 108.839 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 tppt? -59.97 -39.2 84.83 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.778 0.799 . . . . 2.82 109.207 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -60.0 -45.67 91.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.924 -0.485 . . . . 1.73 110.703 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.656 HD23 ' HA ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -60.06 -35.29 74.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.298 -0.876 . . . . 1.53 110.344 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.515 HD12 ' HG ' ' A' ' 36' ' ' LEU . 2.2 mp -58.66 -39.77 81.59 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.234 -0.916 . . . . 1.36 109.643 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.451 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 24.6 p -60.01 -40.01 87.81 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 109.095 -0.705 . . . . 1.31 109.095 179.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.5 mt -65.16 -47.66 76.27 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.986 -0.746 . . . . 0.72 108.986 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -61.39 -31.57 71.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.148 -0.686 . . . . 2.38 109.148 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 38' ' ' SER . . . -59.84 -41.5 91.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.698 -0.626 . . . . 0.69 109.419 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.87 -48.64 79.6 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 119.79 -0.764 . . . . 1.9 109.208 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.458 ' CE2' ' CB ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -61.06 -38.51 86.46 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.917 0.865 . . . . 2.03 108.772 178.076 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -60.55 -27.31 67.56 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 116.085 -0.507 . . . . 2.12 111.308 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -55.02 -39.85 69.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.252 -0.905 . . . . 2.41 110.929 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -64.63 -59.85 3.8 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.549 -0.861 . . . . 2.31 110.356 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -165.55 28.89 0.05 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.296 -0.878 . . . . 2.51 111.637 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.98 73.38 0.69 Allowed Glycine 0 N--CA 1.497 2.765 0 N-CA-C 108.994 -1.643 . . . . 1.86 108.994 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 28.9 mm100 -87.02 -16.42 35.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.634 -0.921 . . . . 2.7 111.984 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 30.26 100.22 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 113.267 0.84 . . . . 2.37 113.267 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.607 ' CD1' HG21 ' A' ' 9' ' ' VAL . 32.6 p90 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.125 -0.984 . . . . 2.77 111.492 -178.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp . . . . . 0 N--CA 1.498 1.962 0 CA-C-O 121.525 0.678 . . . . 1.69 109.363 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.5 t -55.42 -44.07 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 N-CA-C 109.348 -0.612 . . . . 1.52 109.348 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.39 -40.5 94.56 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.782 -0.574 . . . . 1.92 110.662 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.458 ' O ' HG22 ' A' ' 9' ' ' VAL . 11.1 m-85 -59.75 -40.05 86.82 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.498 -0.751 . . . . 3.87 110.463 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.868 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 m120 -60.16 -40.21 89.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.574 -0.704 . . . . 1.35 110.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.92 -49.76 76.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.485 -0.759 . . . . 2.93 111.232 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.525 ' HA ' HD13 ' A' ' 39' ' ' LEU . 26.9 m -65.21 -39.95 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 1.07 109.61 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.57 -38.34 84.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.465 -0.772 . . . . 0.42 110.736 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.868 HG23 ' O ' ' A' ' 7' ' ' ASN . 72.7 t -60.1 -50.13 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.642 -0.661 . . . . 0.95 110.7 -177.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.465 ' HG2' HD11 ' A' ' 39' ' ' LEU . 6.7 mp0 -61.87 -50.93 70.25 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.011 -1.056 . . . . 1.84 109.818 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.58 -49.93 4.84 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.974 -1.25 . . . . 0.36 109.974 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.39 -36.8 85.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 122.07 -0.665 . . . . 1.12 111.342 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 68.3 t -59.66 -41.07 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.188 -0.945 . . . . 0.46 109.726 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -59.94 -48.09 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.265 -0.897 . . . . 0.7 108.944 178.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -60.05 -47.6 85.17 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.656 -0.652 . . . . 3.15 110.337 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -62.47 -42.55 99.56 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.589 -0.694 . . . . 2.23 111.192 -178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.7 -40.25 96.32 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.317 -0.865 . . . . 1.02 111.039 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.502 ' HD2' HG21 ' A' ' 29' ' ' VAL . 17.0 tptm -66.33 -40.23 89.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.637 -0.665 . . . . 2.08 109.882 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -28.12 68.12 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.474 -0.936 . . . . 0.81 108.474 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 62.7 mtpt -84.08 8.77 14.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.854 -0.529 . . . . 2.11 111.002 178.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 95.3 mttt 57.61 27.57 14.4 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 2.28 111.094 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.419 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -57.18 163.43 3.19 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.739 -0.601 . . . . 0.71 110.706 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.419 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 43.7 Cg_endo -68.9 166.17 27.37 Favored 'Trans proline' 0 C--N 1.315 -1.217 0 O-C-N 123.592 1.312 . . . . 0.93 110.081 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -58.52 -34.33 70.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.671 -0.643 . . . . 2.0 110.811 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.65 -39.79 74.31 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.583 -0.698 . . . . 2.22 110.419 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.86 -46.57 57.47 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.658 -0.651 . . . . 1.46 111.326 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.502 HG21 ' HD2' ' A' ' 20' ' ' LYS . 94.3 t -69.41 -50.05 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.251 -0.906 . . . . 0.65 111.134 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.446 ' O ' HG12 ' A' ' 33' ' ' VAL . 59.3 m-20 -59.91 -49.11 78.98 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.454 -0.779 . . . . 1.33 111.277 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.0 -46.21 91.68 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.506 -0.747 . . . . 0.46 110.766 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.31 80.5 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 119.867 -0.733 . . . . 0.39 110.159 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -64.97 -39.63 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.19 -1.041 . . . . 0.57 108.19 179.407 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.441 ' HA ' HD12 ' A' ' 37' ' ' LEU . 34.7 tttp -61.52 -41.64 97.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.105 -1.072 . . . . 2.82 108.105 177.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -65.84 -42.84 90.0 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.539 -0.912 . . . . 1.73 108.539 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.602 HD13 ' C ' ' A' ' 36' ' ' LEU . 3.3 tm? -60.04 -40.81 90.66 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 115.952 -0.567 . . . . 1.53 109.719 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 34' ' ' LYS . 74.4 mt -59.99 -39.71 86.66 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.611 -0.68 . . . . 1.36 109.754 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.6 t -59.87 -36.62 77.27 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 1.31 109.521 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 9' ' ' VAL . 82.3 mt -60.05 -51.09 71.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.611 -0.681 . . . . 0.72 110.117 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -60.98 -39.33 89.22 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.527 -0.733 . . . . 2.38 109.627 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.55 91.87 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.766 -0.584 . . . . 0.69 110.487 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -60.79 -49.45 77.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.306 -0.871 . . . . 1.9 109.591 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -61.37 -38.26 86.36 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.688 -0.632 . . . . 2.03 110.092 178.749 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -59.89 -37.78 80.36 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.72 -0.613 . . . . 2.12 110.771 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -57.98 -39.46 78.23 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.423 -0.798 . . . . 2.41 111.25 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -61.21 -54.33 45.57 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.12 -0.988 . . . . 2.31 111.229 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.573 ' O ' HG22 ' A' ' 47' ' ' THR . 41.4 m -156.61 16.47 0.31 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.256 -0.902 . . . . 2.51 111.433 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.74 29.97 68.89 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.48 -1.048 . . . . 1.86 110.48 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' GLU . 91.5 mm-40 -83.95 -23.83 30.94 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.32 -1.106 . . . . 2.7 110.866 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.432 ' HA ' ' HB3' ' A' ' 43' ' ' TYR . 8.5 pt-20 40.64 -175.1 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 121.805 0.812 . . . . 2.37 112.855 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.1 t80 . . . . . 0 N--CA 1.5 2.059 0 O-C-N 121.152 -0.968 . . . . 2.77 110.595 -178.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 N--CA 1.499 2.021 0 CA-C-O 121.464 0.649 . . . . 1.69 110.436 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -60.01 -48.94 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 1.52 110.608 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -45.02 94.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.297 -0.877 . . . . 1.92 110.604 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.418 ' O ' HG22 ' A' ' 9' ' ' VAL . 33.6 t80 -59.95 -43.5 94.97 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.419 -0.801 . . . . 3.87 110.361 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.645 ' O ' HG13 ' A' ' 11' ' ' VAL . 96.2 m-20 -60.01 -40.26 88.65 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.516 -0.74 . . . . 1.35 110.736 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.609 ' HG3' HD13 ' A' ' 39' ' ' LEU . 8.8 tpt180 -60.01 -50.02 75.37 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.522 -0.736 . . . . 2.93 110.611 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.799 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.72 -40.05 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.12 -0.987 . . . . 1.07 109.253 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.99 74.17 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 112.832 0.679 . . . . 0.42 112.832 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 7' ' ' ASN . 33.4 m -60.08 -49.01 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.229 -0.92 . . . . 0.95 111.968 -177.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.598 ' CD ' HD11 ' A' ' 39' ' ' LEU . 75.6 mt-30 -62.94 -42.61 99.86 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.872 -1.143 . . . . 1.84 109.492 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.842 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -43.63 -52.6 6.39 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.695 -1.362 . . . . 0.36 109.695 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -62.68 -34.76 77.76 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.926 -0.749 . . . . 1.12 111.221 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 11' ' ' VAL . 92.0 t -59.62 -40.04 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.29 -0.881 . . . . 0.46 109.584 -179.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.616 HG22 HG23 ' A' ' 33' ' ' VAL . 55.6 t -59.99 -49.97 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 N-CA-C 108.592 -0.892 . . . . 0.7 108.592 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -64.85 -40.93 95.95 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.37 0.605 . . . . 3.15 110.536 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.0 -48.62 80.96 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.73 -0.606 . . . . 2.23 110.775 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 28' ' ' ASP . 87.1 mt -59.99 -40.51 89.44 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.643 -0.661 . . . . 1.02 110.41 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.829 ' HD3' HG21 ' A' ' 29' ' ' VAL . 35.0 tptt -69.92 -39.67 76.0 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.618 -0.882 . . . . 2.08 108.618 179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.01 -31.72 70.2 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.0 -0.741 . . . . 0.81 109.0 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.548 ' HD3' HD23 ' A' ' 19' ' ' LEU . 15.9 ptmt -92.23 19.4 7.03 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 119.529 -0.869 . . . . 2.11 110.488 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.7 mttm 59.6 20.26 8.83 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.451 -0.78 . . . . 2.28 111.678 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.4 158.7 13.82 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.413 -0.805 . . . . 0.71 109.712 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -73.25 167.23 27.85 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.322 1.169 . . . . 0.93 110.153 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -54.96 -24.56 24.52 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.522 -0.736 . . . . 2.0 109.566 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -57.02 -41.86 79.33 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.728 -0.608 . . . . 2.22 110.209 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.585 ' HB3' HD22 ' A' ' 19' ' ' LEU . 69.2 m-20 -75.44 -48.44 22.76 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.685 -0.634 . . . . 1.46 111.32 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.829 HG21 ' HD3' ' A' ' 20' ' ' LYS . 79.5 t -63.35 -49.54 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 0.65 109.786 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.95 -40.21 88.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.58 -0.7 . . . . 1.33 110.883 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.78 -51.64 68.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.301 -0.874 . . . . 0.46 110.538 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.14 90.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.629 -0.67 . . . . 0.39 109.296 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.616 HG23 HG22 ' A' ' 16' ' ' VAL . 9.1 t -64.59 -45.67 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 108.455 -0.943 . . . . 0.57 108.455 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -60.01 -40.95 91.02 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.261 -0.899 . . . . 2.82 108.822 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -65.11 -49.4 70.11 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.466 -0.939 . . . . 1.73 108.466 178.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.842 HD22 ' HA2' ' A' ' 13' ' ' GLY . 6.7 tp -60.0 -39.54 86.12 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 115.821 -0.627 . . . . 1.53 109.689 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.0 mt -58.22 -38.66 77.26 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.419 -0.8 . . . . 1.36 109.608 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.1 t -60.5 -40.7 92.32 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.607 -0.683 . . . . 1.31 109.475 178.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.799 ' HB3' HG12 ' A' ' 9' ' ' VAL . 46.4 mt -66.8 -50.95 60.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 109.008 -0.738 . . . . 0.72 109.008 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -59.99 -39.89 87.32 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.524 0.678 . . . . 2.38 109.274 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.81 80.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.907 -0.496 . . . . 0.69 110.512 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -60.04 -49.95 75.64 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.289 -0.882 . . . . 1.9 110.236 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.37 -39.96 92.55 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.573 -0.705 . . . . 2.03 110.001 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -60.0 -39.35 85.47 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.758 -0.589 . . . . 2.12 110.484 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -58.79 -37.63 76.77 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.549 -0.72 . . . . 2.41 111.12 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -61.26 -54.48 43.49 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.195 -0.941 . . . . 2.31 111.055 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.16 18.21 0.36 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.113 -0.992 . . . . 2.51 111.659 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.97 33.58 70.28 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 110.466 -1.053 . . . . 1.86 110.466 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -86.72 -13.0 46.62 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.33 -1.1 . . . . 2.7 111.628 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 35.92 -156.03 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 N-CA-C 112.807 0.669 . . . . 2.37 112.807 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.6 t80 . . . . . 0 N--CA 1.497 1.905 0 O-C-N 121.17 -0.956 . . . . 2.77 110.552 -179.569 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.4 ' C ' HD23 ' A' ' 3' ' ' LEU . 7.9 tt . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 120.797 0.332 . . . . 1.69 110.729 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.479 HG13 HD22 ' A' ' 5' ' ' LEU . 2.9 p -56.23 -40.88 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 O-C-N 121.272 -0.892 . . . . 1.52 110.461 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.479 HD22 HG13 ' A' ' 4' ' ' VAL . 3.5 mm? -59.79 -40.63 88.99 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.558 -0.714 . . . . 1.92 109.633 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.428 ' O ' HG22 ' A' ' 9' ' ' VAL . 10.3 m-85 -59.94 -40.12 87.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.611 -0.681 . . . . 3.87 110.016 178.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.832 ' O ' HG23 ' A' ' 11' ' ' VAL . 97.6 m-20 -61.47 -41.47 97.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.618 -0.676 . . . . 1.35 110.704 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttt85 -59.95 -49.73 76.55 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.541 -0.725 . . . . 2.93 111.101 -178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.911 ' HA ' HD13 ' A' ' 39' ' ' LEU . 33.1 m -66.72 -39.83 84.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.437 -0.789 . . . . 1.07 108.93 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.84 -38.57 85.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.797 -0.565 . . . . 0.42 110.97 178.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 7' ' ' ASN . 60.1 t -60.02 -49.95 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.455 -0.778 . . . . 0.95 109.985 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.843 ' HG3' HD11 ' A' ' 39' ' ' LEU . 30.1 mm100 -60.22 -51.91 67.54 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.078 -1.014 . . . . 1.84 109.283 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.01 -58.26 2.34 Favored Glycine 0 N--CA 1.506 3.331 0 N-CA-C 110.68 -0.968 . . . . 0.36 110.68 -178.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.66 -38.52 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.912 -0.758 . . . . 1.12 111.088 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 11' ' ' VAL . 85.2 t -59.75 -39.96 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.313 -0.867 . . . . 0.46 109.683 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.552 HG22 ' CB ' ' A' ' 32' ' ' ALA . 60.1 t -60.04 -49.76 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 N-CA-C 108.864 -0.791 . . . . 0.7 108.864 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -59.98 -43.48 95.1 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.72 -0.612 . . . . 3.15 110.103 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.58 -41.55 97.57 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 2.23 111.341 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.35 -42.92 96.76 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.24 -0.913 . . . . 1.02 109.9 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.57 ' CD ' HG21 ' A' ' 29' ' ' VAL . 20.0 tptp -65.75 -40.0 91.67 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.794 -0.817 . . . . 2.08 108.794 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -26.69 66.72 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.725 -0.842 . . . . 0.81 108.725 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -86.97 10.28 16.85 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.113 -0.635 . . . . 2.11 110.793 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 94.4 mttt 57.35 21.38 6.74 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.294 -0.879 . . . . 2.28 111.091 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.418 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -60.87 162.47 12.22 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.615 -0.678 . . . . 0.71 109.406 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.46 162.69 39.64 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.211 1.111 . . . . 0.93 111.047 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -54.48 -24.45 20.42 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.735 -0.603 . . . . 2.0 110.197 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -59.53 -40.94 88.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.643 -0.661 . . . . 2.22 110.059 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.418 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 70.0 m-20 -72.61 -45.61 58.24 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.482 -0.761 . . . . 1.46 110.843 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.57 HG21 ' CD ' ' A' ' 20' ' ' LYS . 87.1 t -67.02 -50.77 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.553 -0.717 . . . . 0.65 110.305 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' HG12 ' A' ' 33' ' ' VAL . 86.3 m-20 -60.13 -43.62 95.54 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.573 -0.705 . . . . 1.33 111.121 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.01 73.47 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.381 -0.824 . . . . 0.46 110.655 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.552 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -65.38 -42.53 92.59 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 120.261 -0.576 . . . . 0.39 110.492 -179.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.67 -36.57 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.084 -1.08 . . . . 0.57 108.084 179.214 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -60.06 -44.13 94.93 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.98 -1.118 . . . . 2.82 107.98 177.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -62.44 -40.03 95.29 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.85 0.833 . . . . 1.73 108.852 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.882 HD22 HD12 ' A' ' 39' ' ' LEU . 2.8 tm? -59.71 -41.5 90.96 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.4 -0.593 . . . . 1.53 109.4 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.4 mt -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.575 -0.703 . . . . 1.36 110.39 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 p -62.12 -27.92 69.27 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.355 -0.841 . . . . 1.31 109.495 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.911 HD13 ' HA ' ' A' ' 9' ' ' VAL . 83.1 mt -66.9 -58.57 4.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.265 -0.897 . . . . 0.72 109.131 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.412 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 1.3 ptpm? -61.77 -35.53 78.41 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.762 0.791 . . . . 2.38 109.072 178.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.412 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -59.98 -50.05 75.26 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 116.106 -0.497 . . . . 0.69 109.948 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.34 -40.06 93.16 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.508 -0.745 . . . . 1.9 109.759 179.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.46 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -58.98 -39.59 82.22 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.682 -0.636 . . . . 2.03 109.989 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -59.94 -40.04 87.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.604 -0.685 . . . . 2.12 111.046 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.9 -39.25 80.92 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.397 -0.814 . . . . 2.41 111.238 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.673 ' O ' HG23 ' A' ' 47' ' ' THR . 58.4 mttm -64.94 -59.95 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.28 -0.968 . . . . 2.31 110.767 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.673 HG23 ' O ' ' A' ' 46' ' ' LYS . 1.0 OUTLIER -159.46 12.52 0.14 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.254 -0.904 . . . . 2.51 112.741 -179.771 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.84 55.23 20.75 Favored Glycine 0 N--CA 1.498 2.821 0 N-CA-C 109.169 -1.573 . . . . 1.86 109.169 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.46 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 97.1 mt-30 -83.22 -20.49 34.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.579 -0.954 . . . . 2.7 111.61 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 30.28 85.8 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.986 0 N-CA-C 112.892 0.701 . . . . 2.37 112.892 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.1 p90 . . . . . 0 N--CA 1.497 1.903 0 O-C-N 121.449 -0.782 . . . . 2.77 111.252 -178.797 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp . . . . . 0 N--CA 1.501 2.099 0 CA-C-O 121.616 0.722 . . . . 1.69 110.114 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 90.5 t -59.22 -40.11 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.836 -0.54 . . . . 1.52 110.425 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.04 -48.8 80.2 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.417 -0.802 . . . . 1.92 110.565 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.416 ' O ' HG22 ' A' ' 9' ' ' VAL . 13.3 m-85 -59.88 -39.76 86.38 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.519 -0.738 . . . . 3.87 110.796 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.799 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.5 m-20 -59.91 -39.46 85.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.419 -0.801 . . . . 1.35 110.171 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.1 mmt-85 -59.93 -50.72 72.66 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.502 -0.749 . . . . 2.93 110.342 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.873 ' HA ' HD13 ' A' ' 39' ' ' LEU . 35.5 m -67.79 -40.04 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 C-N-CA 119.48 -0.888 . . . . 1.07 109.348 178.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.96 -36.79 77.86 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.571 -0.706 . . . . 0.42 110.278 178.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 7' ' ' ASN . 40.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.486 -0.759 . . . . 0.95 111.305 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.524 ' CD ' HD11 ' A' ' 39' ' ' LEU . 2.8 mp0 -60.0 -52.62 64.62 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.045 -1.034 . . . . 1.84 110.055 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.551 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -42.11 -54.85 4.4 Favored Glycine 0 N--CA 1.508 3.485 0 N-CA-C 110.178 -1.169 . . . . 0.36 110.178 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -65.61 -38.3 89.05 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.837 -0.802 . . . . 1.12 111.72 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 11' ' ' VAL . 54.5 t -59.68 -40.01 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.219 -0.925 . . . . 0.46 109.233 -178.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.3 t -60.0 -49.99 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.398 -0.814 . . . . 0.7 109.368 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -60.0 -43.36 95.23 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.441 -0.787 . . . . 3.15 109.761 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -60.34 -47.61 85.28 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.756 -0.59 . . . . 2.23 110.772 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.96 -44.04 94.67 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.61 -0.682 . . . . 1.02 110.591 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.677 ' HD3' HG21 ' A' ' 29' ' ' VAL . 38.3 tptt -65.69 -40.3 92.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.521 -0.737 . . . . 2.08 109.146 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.78 -26.54 68.68 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.499 -0.926 . . . . 0.81 108.499 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 45.6 mtpt -87.74 12.01 13.9 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.754 -0.591 . . . . 2.11 110.644 179.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.8 mtmt 59.8 20.8 9.64 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.383 -0.823 . . . . 2.28 111.195 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.87 161.78 6.18 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.461 -0.774 . . . . 0.71 109.663 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.22 162.1 43.55 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.379 1.2 . . . . 0.93 110.333 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -55.64 -27.35 49.28 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.589 -0.694 . . . . 2.0 110.028 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -59.97 -39.95 87.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.73 -0.607 . . . . 2.22 110.294 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -70.53 -43.12 70.24 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.205 -0.934 . . . . 1.46 110.676 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.677 HG21 ' HD3' ' A' ' 20' ' ' LYS . 61.4 t -69.36 -51.96 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.485 -0.759 . . . . 0.65 110.047 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' HG12 ' A' ' 33' ' ' VAL . 61.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 1.33 110.879 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.81 -47.48 83.26 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.382 -0.824 . . . . 0.46 110.399 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.95 84.62 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.09 -0.644 . . . . 0.39 110.279 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -64.66 -35.93 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.304 -0.998 . . . . 0.57 108.304 179.344 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -60.08 -42.86 95.49 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.318 -0.993 . . . . 2.82 108.318 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -60.58 -40.0 90.1 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.326 -0.99 . . . . 1.73 108.326 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.696 HD23 HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -54.85 -44.29 73.84 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.804 -0.634 . . . . 1.53 110.54 179.565 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.444 -0.785 . . . . 1.36 109.699 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.0 t -59.87 -32.68 70.94 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.297 -0.631 . . . . 1.31 109.297 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.873 HD13 ' HA ' ' A' ' 9' ' ' VAL . 78.8 mt -65.52 -57.97 6.92 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 120.077 -0.649 . . . . 0.72 109.416 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.02 -33.44 72.0 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.421 -0.799 . . . . 2.38 109.607 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.48 -42.24 91.61 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.267 -0.573 . . . . 0.69 109.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.02 -48.14 82.95 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 107.98 -1.119 . . . . 1.9 107.98 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -60.29 -39.05 85.54 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.723 0.773 . . . . 2.03 109.417 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -60.01 -33.08 71.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.831 -0.543 . . . . 2.12 111.065 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.46 -39.97 71.03 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.463 -0.773 . . . . 2.41 110.14 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.83 -74.93 0.1 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.506 -0.746 . . . . 2.31 109.868 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.3 t -160.05 30.17 0.18 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.473 -0.767 . . . . 2.51 110.241 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.18 68.4 1.65 Allowed Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.517 -1.433 . . . . 1.86 109.517 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -88.41 -26.85 21.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.586 -0.949 . . . . 2.7 111.428 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 11.2 pt-20 31.23 97.56 0.0 OUTLIER 'General case' 0 N--CA 1.519 3.003 0 N-CA-C 112.772 0.656 . . . . 2.37 112.772 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.46 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 46.7 p90 . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.103 -0.998 . . . . 2.77 111.52 -178.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 121.68 0.752 . . . . 1.69 109.467 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.18 -44.47 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.984 -0.448 . . . . 1.52 109.945 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.02 -44.93 94.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.431 -0.793 . . . . 1.92 109.496 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -60.06 -41.65 92.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.743 -0.598 . . . . 3.87 111.27 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.691 ' O ' HG23 ' A' ' 11' ' ' VAL . 26.9 m120 -60.04 -40.63 90.07 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.472 -0.768 . . . . 1.35 111.213 -178.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.4 mtp180 -60.03 -50.37 73.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.383 -0.823 . . . . 2.93 110.503 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.782 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.67 -40.03 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.754 -0.832 . . . . 1.07 108.754 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -38.46 82.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.708 -0.62 . . . . 0.42 110.554 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.691 HG23 ' O ' ' A' ' 7' ' ' ASN . 30.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.553 -0.717 . . . . 0.95 110.46 -179.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -60.67 -53.58 55.76 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.259 -0.9 . . . . 1.84 109.738 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.735 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -39.32 -55.5 2.48 Favored Glycine 0 N--CA 1.51 3.567 0 N-CA-C 110.632 -0.987 . . . . 0.36 110.632 -178.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -61.95 -38.52 88.8 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.92 -0.753 . . . . 1.12 111.388 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' ' 11' ' ' VAL . 99.4 t -59.94 -41.96 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.319 -0.863 . . . . 0.46 109.51 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.9 t -60.7 -47.65 92.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 0.7 109.378 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -59.99 -41.14 91.42 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.56 -0.713 . . . . 3.15 110.502 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.95 -40.99 97.69 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.515 -0.74 . . . . 2.23 111.201 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.99 -43.88 94.88 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.347 -0.845 . . . . 1.02 110.656 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.746 ' CD ' HG21 ' A' ' 29' ' ' VAL . 17.2 tptt -65.15 -39.98 93.72 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.713 -0.847 . . . . 2.08 108.713 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.95 -24.19 66.84 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.71 -0.848 . . . . 0.81 108.71 177.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -88.13 10.52 19.04 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 2.11 110.423 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt 60.08 19.92 9.14 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.375 -0.828 . . . . 2.28 111.396 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.92 163.42 9.84 Favored Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.562 -0.711 . . . . 0.71 109.968 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.2 160.49 45.16 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.321 1.169 . . . . 0.93 110.392 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -56.91 -29.49 63.08 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.623 -0.673 . . . . 2.0 111.002 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.93 -40.01 75.57 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.36 -0.838 . . . . 2.22 110.688 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -70.51 -43.37 69.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.417 -0.802 . . . . 1.46 110.576 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.746 HG21 ' CD ' ' A' ' 20' ' ' LYS . 77.7 t -68.41 -47.8 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.637 -0.664 . . . . 0.65 110.648 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -59.97 -44.05 94.68 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.391 -0.818 . . . . 1.33 110.349 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.4 76.2 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.556 -0.715 . . . . 0.46 110.138 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.05 -43.2 96.23 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.647 . . . . 0.39 110.624 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -35.29 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 108.492 -0.929 . . . . 0.57 108.492 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -60.02 -40.04 87.95 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.442 -1.318 . . . . 2.82 107.442 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -60.25 -39.96 88.62 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.209 -1.034 . . . . 1.73 108.209 177.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.735 HD11 ' HA2' ' A' ' 13' ' ' GLY . 0.6 OUTLIER -56.98 -45.03 83.24 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 116.033 -0.53 . . . . 1.53 110.173 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -38.34 72.84 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.528 -0.732 . . . . 1.36 109.871 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -61.38 -40.03 92.85 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 109.151 -0.685 . . . . 1.31 109.151 178.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.782 ' HB3' HG12 ' A' ' 9' ' ' VAL . 55.7 mt -65.99 -55.16 18.15 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.619 -0.882 . . . . 0.72 108.619 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -60.0 -36.49 77.31 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.363 0.602 . . . . 2.38 109.651 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.72 94.79 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.822 -0.549 . . . . 0.69 110.213 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.97 -48.0 83.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.269 -0.894 . . . . 1.9 109.142 178.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.6 -39.96 90.07 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.623 0.725 . . . . 2.03 109.217 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.424 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 88.6 tttt -60.05 -38.33 82.5 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.707 -0.62 . . . . 2.12 110.958 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.29 -39.96 80.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.546 -0.721 . . . . 2.41 112.11 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 mttt -61.08 -53.51 56.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.031 -1.043 . . . . 2.31 110.654 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.498 ' O ' HG22 ' A' ' 47' ' ' THR . 22.3 m -156.76 13.91 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.487 -0.758 . . . . 2.51 112.021 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.424 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 70.02 39.41 74.0 Favored Glycine 0 N--CA 1.498 2.814 0 N-CA-C 110.201 -1.16 . . . . 1.86 110.201 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 50' ' ' GLU . 45.4 mt-30 -85.59 -20.13 29.99 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.365 -1.079 . . . . 2.7 111.483 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.535 ' O ' ' O ' ' A' ' 49' ' ' GLN . 15.5 pt-20 42.09 161.92 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.704 1.24 . . . . 2.37 113.853 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.9 t80 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 120.872 -1.142 . . . . 2.77 110.711 -179.246 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.527 HD23 ' C ' ' A' ' 3' ' ' LEU . 7.0 tt . . . . . 0 N--CA 1.5 2.047 0 CA-C-O 121.273 0.558 . . . . 1.69 110.685 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.629 HG13 HD22 ' A' ' 5' ' ' LEU . 6.3 p -58.83 -39.4 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.677 -0.639 . . . . 1.52 110.379 -179.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.629 HD22 HG13 ' A' ' 4' ' ' VAL . 3.9 mm? -58.97 -46.2 88.68 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.733 -0.605 . . . . 1.92 110.426 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.443 ' O ' HG22 ' A' ' 9' ' ' VAL . 44.0 m-85 -60.0 -40.05 87.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 3.87 110.627 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.837 ' O ' HG23 ' A' ' 11' ' ' VAL . 99.5 m-20 -60.22 -40.1 88.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.255 -0.903 . . . . 1.35 110.553 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -60.05 -49.98 75.53 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.452 -0.78 . . . . 2.93 111.083 -179.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.862 HG12 ' HB3' ' A' ' 39' ' ' LEU . 32.6 m -67.6 -39.95 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 119.383 -0.927 . . . . 1.07 108.913 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.407 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -61.89 -38.14 87.2 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.708 -0.62 . . . . 0.42 111.276 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.837 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.5 t -59.99 -50.02 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.803 . . . . 0.95 110.465 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.406 ' HB3' ' HB2' ' A' ' 36' ' ' LEU . 97.8 mm-40 -60.28 -50.05 75.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.101 -1.04 . . . . 1.84 109.081 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.415 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -41.48 -56.24 3.55 Favored Glycine 0 N--CA 1.509 3.545 0 N-CA-C 110.282 -1.127 . . . . 0.36 110.282 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -61.6 -40.04 93.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.866 -0.785 . . . . 1.12 110.316 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 11' ' ' VAL . 91.9 t -59.7 -39.26 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.427 -0.796 . . . . 0.46 109.307 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.9 t -59.92 -50.06 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 N-CA-C 108.593 -0.891 . . . . 0.7 108.593 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.1 ttt85 -60.27 -41.42 93.23 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.742 -0.599 . . . . 3.15 110.178 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.6 -39.94 90.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.573 -0.705 . . . . 2.23 110.573 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.557 HD23 ' HD3' ' A' ' 22' ' ' LYS . 86.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.532 -0.73 . . . . 1.02 110.104 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HD3' HG21 ' A' ' 29' ' ' VAL . 10.5 mmtp -69.1 -40.05 78.6 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.574 0.702 . . . . 2.08 109.24 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.08 -33.56 72.24 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.105 -0.702 . . . . 0.81 109.105 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.557 ' HD3' HD23 ' A' ' 19' ' ' LEU . 14.2 ptmt -91.39 17.57 8.31 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.701 -0.8 . . . . 2.11 110.946 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt 59.59 22.38 11.04 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.359 -0.838 . . . . 2.28 111.329 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.91 151.55 23.86 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.44 -0.788 . . . . 0.71 110.26 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -69.09 170.71 15.15 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.411 1.216 . . . . 0.93 111.032 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.9 -32.63 67.91 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.195 0.521 . . . . 2.0 110.5 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -59.23 -39.97 84.41 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.6 -0.688 . . . . 2.22 111.169 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.521 ' HB3' HD22 ' A' ' 19' ' ' LEU . 80.0 m-20 -70.16 -40.57 74.66 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.414 -0.804 . . . . 1.46 110.639 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.506 HG21 ' HD3' ' A' ' 20' ' ' LYS . 83.6 t -68.57 -52.17 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.653 -0.654 . . . . 0.65 110.438 -179.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.458 ' O ' HG12 ' A' ' 33' ' ' VAL . 79.0 m-20 -60.07 -43.85 95.16 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.59 -0.694 . . . . 1.33 110.716 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.03 -47.49 86.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.448 -0.782 . . . . 0.46 110.377 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.54 -44.75 89.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.599 -0.688 . . . . 0.39 110.365 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.458 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.52 -38.21 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 108.143 -1.058 . . . . 0.57 108.143 178.852 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -60.0 -42.04 93.39 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.126 -1.064 . . . . 2.82 108.126 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -62.94 -47.16 84.42 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.353 -0.981 . . . . 1.73 108.353 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.538 ' O ' HD12 ' A' ' 36' ' ' LEU . 2.5 tp -60.01 -41.31 91.89 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.831 -0.622 . . . . 1.53 109.503 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.19 -38.36 79.64 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.59 -0.694 . . . . 1.36 109.614 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.9 t -60.77 -41.14 94.91 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.089 -0.708 . . . . 1.31 109.089 178.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 9' ' ' VAL . 63.3 mt -63.07 -50.18 71.6 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.467 -0.938 . . . . 0.72 108.467 178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.02 -40.01 87.79 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.653 0.74 . . . . 2.38 109.341 177.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -49.31 78.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.867 -0.521 . . . . 0.69 110.958 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -49.28 78.28 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.215 -0.928 . . . . 1.9 109.979 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.09 -37.01 78.68 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.572 0.701 . . . . 2.03 109.991 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.98 -40.0 87.65 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.681 -0.637 . . . . 2.12 111.297 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.08 -38.25 73.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.464 -0.773 . . . . 2.41 111.257 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.82 -55.17 36.2 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.267 -0.895 . . . . 2.31 110.849 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 47' ' ' THR . 29.7 m -158.45 16.85 0.21 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.277 -0.889 . . . . 2.51 111.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.87 37.8 75.23 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.433 -1.467 . . . . 1.86 109.433 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' O ' ' A' ' 50' ' ' GLU . 14.3 mm100 -81.5 -29.27 33.69 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.62 -0.93 . . . . 2.7 110.795 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 49' ' ' GLN . 8.5 pt-20 40.56 -172.47 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.505 0.669 . . . . 2.37 112.543 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.401 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.0 t80 . . . . . 0 N--CA 1.498 1.972 0 O-C-N 121.169 -0.957 . . . . 2.77 110.857 -179.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.1 tp . . . . . 0 N--CA 1.501 2.083 0 CA-C-O 121.084 0.469 . . . . 1.69 111.57 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 5' ' ' LEU . 10.5 p -59.02 -41.96 84.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.549 -0.719 . . . . 1.52 110.861 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.45 ' N ' HG13 ' A' ' 4' ' ' VAL . 2.6 mm? -59.97 -40.6 89.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.598 -0.689 . . . . 1.92 109.936 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.41 ' HH ' ' HH ' ' A' ' 51' ' ' TYR . 64.9 t80 -60.02 -40.0 87.8 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.479 -0.763 . . . . 3.87 109.883 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.655 ' O ' HG23 ' A' ' 11' ' ' VAL . 74.5 m-20 -59.97 -40.0 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.476 -0.765 . . . . 1.35 109.804 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -60.03 -50.43 73.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.585 -0.697 . . . . 2.93 111.269 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.675 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.0 m -70.02 -40.9 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.225 -0.922 . . . . 1.07 109.575 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.423 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -61.13 -44.69 96.94 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.612 -0.68 . . . . 0.42 111.227 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 7' ' ' ASN . 56.3 t -60.06 -46.7 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.384 -0.823 . . . . 0.95 110.362 -178.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -60.03 -49.13 78.88 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.118 -0.989 . . . . 1.84 109.347 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.474 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -39.47 -48.87 3.02 Favored Glycine 0 N--CA 1.51 3.631 0 N-CA-C 110.18 -1.168 . . . . 0.36 110.18 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.38 -34.38 78.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.879 -0.777 . . . . 1.12 110.873 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.71 -43.66 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.284 -0.885 . . . . 0.46 109.264 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.569 HG13 HG13 ' A' ' 29' ' ' VAL . 55.9 t -60.47 -45.51 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 N-CA-C 107.911 -1.144 . . . . 0.7 107.911 177.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -60.32 -40.02 89.11 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 116.04 -0.527 . . . . 3.15 110.879 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.97 -42.5 94.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.48 -0.763 . . . . 2.23 109.93 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 22' ' ' LYS . 89.1 mt -60.4 -40.18 90.0 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.493 0.663 . . . . 1.02 110.612 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.689 ' HE2' HG11 ' A' ' 29' ' ' VAL . 20.7 mmtt -68.67 -39.99 80.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.392 -0.818 . . . . 2.08 109.052 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -30.86 69.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.073 -0.714 . . . . 0.81 109.073 178.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.448 ' HG2' ' HA ' ' A' ' 19' ' ' LEU . 17.7 ptpt -94.31 19.33 9.62 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.771 -0.771 . . . . 2.11 110.773 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? 56.9 24.47 9.36 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.423 -0.798 . . . . 2.28 111.082 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.86 59.62 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.66 -0.65 . . . . 0.71 110.369 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.71 159.38 51.44 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.473 1.249 . . . . 0.93 110.684 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -55.17 -27.53 46.34 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.672 -0.642 . . . . 2.0 109.611 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -59.32 -40.12 85.26 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.787 -0.571 . . . . 2.22 110.047 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' 19' ' ' LEU . 74.3 m-20 -70.73 -45.52 64.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.535 -0.728 . . . . 1.46 110.006 179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.689 HG11 ' HE2' ' A' ' 20' ' ' LYS . 66.9 t -67.31 -40.49 84.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.737 -0.602 . . . . 0.65 109.801 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.425 ' O ' HG12 ' A' ' 33' ' ' VAL . 77.9 m-20 -60.07 -49.01 79.34 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.596 -0.69 . . . . 1.33 110.943 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.19 91.14 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.191 -0.943 . . . . 0.46 110.562 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.27 89.02 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.39 110.837 -179.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.499 ' O ' HD23 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -66.25 -39.49 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.239 -0.913 . . . . 0.57 108.646 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -60.2 -40.88 91.62 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.173 -1.047 . . . . 2.82 108.173 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -65.72 -44.68 85.3 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.126 -1.064 . . . . 1.73 108.126 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 39' ' ' LEU . 14.4 tp -59.06 -48.86 80.07 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 115.54 -0.754 . . . . 1.53 110.176 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.544 HD13 ' HD2' ' A' ' 40' ' ' LYS . 4.1 mm? -58.4 -37.46 75.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.318 -0.864 . . . . 1.36 109.657 179.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -59.97 -36.76 77.83 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.545 -0.722 . . . . 1.31 109.339 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.675 ' HB3' HG12 ' A' ' 9' ' ' VAL . 94.0 mt -59.95 -41.49 91.99 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.505 -0.747 . . . . 0.72 109.283 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.544 ' HD2' HD13 ' A' ' 37' ' ' LEU . 98.3 mttt -62.7 -40.44 97.13 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 120.149 -0.62 . . . . 2.38 109.511 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -40.61 89.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.79 -0.569 . . . . 0.69 110.498 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -60.15 -48.7 80.64 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.517 -0.739 . . . . 1.9 109.639 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -60.04 -40.44 89.39 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 2.03 110.031 179.142 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.435 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 97.9 mttt -62.71 -23.85 67.36 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.725 -0.609 . . . . 2.12 111.979 -179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.07 -39.97 79.87 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.272 -0.893 . . . . 2.41 111.014 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.611 ' O ' HG23 ' A' ' 47' ' ' THR . 42.1 mmtm -64.26 -56.14 16.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.538 -0.726 . . . . 2.31 110.657 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 46' ' ' LYS . 0.2 OUTLIER -163.21 27.28 0.09 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.461 -0.774 . . . . 2.51 110.804 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.435 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 71.62 41.1 57.92 Favored Glycine 0 N--CA 1.497 2.737 0 C-N-CA 120.012 -1.09 . . . . 1.86 110.387 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 70.7 mt-30 -83.45 -23.01 32.44 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.31 -1.112 . . . . 2.7 110.897 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 36.7 -157.55 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 112.602 0.593 . . . . 2.37 112.602 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.41 ' HH ' ' HH ' ' A' ' 6' ' ' TYR . 64.8 t80 . . . . . 0 N--CA 1.5 2.027 0 O-C-N 121.364 -0.835 . . . . 2.77 110.46 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.532 HD23 ' C ' ' A' ' 3' ' ' LEU . 10.5 tt . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 121.567 0.699 . . . . 1.69 110.005 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 70.0 t -58.8 -49.29 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.864 -0.523 . . . . 1.52 110.062 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.99 -39.99 87.62 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.658 . . . . 1.92 110.625 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -58.68 -40.98 85.14 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.44 -0.787 . . . . 3.87 110.59 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.3 m120 -60.44 -40.38 90.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.612 -0.68 . . . . 1.35 111.421 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -59.97 -53.05 62.42 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.284 -0.885 . . . . 2.93 110.738 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.863 HG12 ' HB3' ' A' ' 39' ' ' LEU . 28.8 m -69.87 -40.06 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.587 -0.696 . . . . 1.07 109.763 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.443 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.15 -43.58 95.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.757 -0.589 . . . . 0.42 111.464 179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.4 t -59.96 -49.23 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.422 -0.799 . . . . 0.95 110.406 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -59.98 -50.14 74.92 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.023 -1.048 . . . . 1.84 109.47 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.648 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -38.77 -49.47 2.51 Favored Glycine 0 N--CA 1.509 3.521 0 N-CA-C 110.654 -0.978 . . . . 0.36 110.654 -178.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -64.53 -37.6 88.12 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.868 -0.783 . . . . 1.12 110.979 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.94 -40.06 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.407 -0.808 . . . . 0.46 109.815 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.472 HG22 ' CB ' ' A' ' 32' ' ' ALA . 83.1 t -59.92 -50.34 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.938 . . . . 0.7 108.826 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -62.53 -40.01 95.41 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.553 0.692 . . . . 3.15 109.783 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.0 tp10 -59.95 -42.44 94.04 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.863 -0.523 . . . . 2.23 111.341 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.727 HD13 ' HB3' ' A' ' 28' ' ' ASP . 89.8 mt -59.95 -44.88 94.12 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.777 0.799 . . . . 1.02 109.928 -179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.749 ' HD2' HG13 ' A' ' 29' ' ' VAL . 17.3 mtpt -69.97 -37.49 75.81 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.497 -0.927 . . . . 2.08 108.497 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.48 70.9 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.708 -0.849 . . . . 0.81 108.708 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.541 ' HE2' HD23 ' A' ' 19' ' ' LEU . 43.8 pttt -93.91 20.93 7.14 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 119.552 -0.859 . . . . 2.11 110.611 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt 60.05 20.38 9.54 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.532 -0.73 . . . . 2.28 111.926 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.521 ' HB2' ' CE ' ' A' ' 22' ' ' LYS . . . -58.19 163.06 4.91 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.424 -0.798 . . . . 0.71 110.614 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -76.77 166.52 26.89 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.449 1.236 . . . . 0.93 111.128 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -58.21 -28.27 64.67 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.736 -0.603 . . . . 2.0 111.316 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -57.67 -40.07 78.54 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.143 -0.973 . . . . 2.22 110.423 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.727 ' HB3' HD13 ' A' ' 19' ' ' LEU . 10.3 m-20 -71.84 -39.98 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.68 0.752 . . . . 1.46 109.52 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.749 HG13 ' HD2' ' A' ' 20' ' ' LYS . 61.1 t -66.95 -53.36 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-N 116.224 -0.444 . . . . 0.65 110.439 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' HG12 ' A' ' 33' ' ' VAL . 86.7 m-20 -59.95 -48.0 83.5 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.567 -0.708 . . . . 1.33 111.269 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.98 83.64 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.298 -0.877 . . . . 0.46 110.519 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.472 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -66.43 -40.01 89.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.647 -0.658 . . . . 0.39 110.554 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.99 -40.04 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.489 -0.884 . . . . 0.57 108.73 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.15 -40.29 93.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.046 -1.062 . . . . 2.82 108.364 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -66.12 -47.16 75.06 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.806 -0.812 . . . . 1.73 108.806 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.648 HD22 ' HA2' ' A' ' 13' ' ' GLY . 3.6 tp -60.06 -43.73 95.22 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.95 -0.469 . . . . 1.53 110.062 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.1 mt -59.98 -39.13 84.61 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.489 -0.757 . . . . 1.36 109.714 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.6 m -60.0 -39.53 86.09 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.271 -0.641 . . . . 1.31 109.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.863 ' HB3' HG12 ' A' ' 9' ' ' VAL . 81.9 mt -60.21 -55.45 33.58 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.435 -0.79 . . . . 0.72 109.91 179.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.555 ' HE3' HD11 ' A' ' 36' ' ' LEU . 98.4 mttt -60.91 -38.56 86.15 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.482 -0.762 . . . . 2.38 109.65 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.65 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 120.433 -0.507 . . . . 0.69 110.592 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.13 -50.95 71.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.124 -0.985 . . . . 1.9 109.792 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -63.54 -39.2 93.8 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.749 0.785 . . . . 2.03 109.801 178.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -60.01 -39.29 85.32 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.872 -0.518 . . . . 2.12 111.013 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -55.44 -37.77 68.15 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.422 -0.799 . . . . 2.41 111.023 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -63.07 -56.4 17.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.253 -0.905 . . . . 2.31 111.322 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.598 HG22 ' O ' ' A' ' 47' ' ' THR . 34.5 m -157.14 18.14 0.29 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.295 -0.878 . . . . 2.51 111.848 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.76 52.25 30.53 Favored Glycine 0 N--CA 1.496 2.655 0 N-CA-C 108.679 -1.769 . . . . 1.86 108.679 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.468 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 90.3 mm-40 -76.63 -37.64 56.01 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.888 . . . . 2.7 111.472 -178.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 32.7 96.83 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.963 0 N-CA-C 112.711 0.634 . . . . 2.37 112.711 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 41.0 p90 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 120.911 -1.118 . . . . 2.77 110.467 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.216 0.531 . . . . 3.98 110.481 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.0 p -65.45 -25.75 67.65 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.708 -0.62 . . . . 1.95 110.26 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.576 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.3 OUTLIER -62.39 -39.99 95.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.52 -0.738 . . . . 1.69 110.534 -179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.97 -49.93 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.19 0 O-C-N 121.327 -0.858 . . . . 1.52 109.626 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 5' ' ' LEU . 4.5 mm? -60.0 -33.3 71.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.468 -0.77 . . . . 1.92 109.214 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.08 -48.61 79.61 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.473 0.654 . . . . 3.87 110.069 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.786 ' O ' HG23 ' A' ' 11' ' ' VAL . 31.2 m120 -61.78 -40.04 93.79 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.724 -0.61 . . . . 1.35 112.017 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.414 ' HG2' HD13 ' A' ' 39' ' ' LEU . 41.7 ttt180 -59.98 -51.69 68.6 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.26 -0.9 . . . . 2.93 111.7 -177.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.421 HG13 ' N ' ' A' ' 10' ' ' ALA . 11.5 p -66.87 -40.0 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.126 -0.984 . . . . 1.07 109.389 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.421 ' N ' HG13 ' A' ' 9' ' ' VAL . . . -59.94 -40.92 90.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.737 -0.602 . . . . 0.42 111.081 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.7 t -60.28 -50.02 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.464 -0.772 . . . . 0.95 110.644 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -62.85 -51.79 65.65 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.17 -0.957 . . . . 1.84 109.739 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.1 -51.6 2.73 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.593 -1.003 . . . . 0.36 110.593 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -64.55 -39.02 92.99 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.899 -0.765 . . . . 1.12 111.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 11' ' ' VAL . 75.8 t -59.79 -42.75 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.345 -0.847 . . . . 0.46 109.693 -178.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.427 HG21 ' HA ' ' A' ' 33' ' ' VAL . 54.5 t -60.01 -48.98 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.479 -0.763 . . . . 0.7 109.819 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.0 -42.31 94.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.719 -0.613 . . . . 3.15 110.622 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -61.26 -48.26 82.27 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.605 -0.685 . . . . 2.23 111.244 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.2 mt -60.0 -42.11 93.54 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.675 -0.64 . . . . 1.02 111.298 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' CD ' HG21 ' A' ' 29' ' ' VAL . 30.4 tptt -63.99 -40.02 95.42 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.479 -0.934 . . . . 2.08 108.479 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.13 -26.48 67.71 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.607 -0.886 . . . . 0.81 108.607 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 36.1 mtpt -85.08 8.92 16.29 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.741 -0.599 . . . . 2.11 110.986 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 55.7 mtmt 58.64 21.54 8.87 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.204 -0.935 . . . . 2.28 110.894 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.501 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -57.66 166.46 1.8 Allowed Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.562 -0.711 . . . . 0.71 110.418 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 43.5 Cg_endo -68.76 161.26 46.19 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.436 1.23 . . . . 0.93 110.207 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -56.84 -29.53 62.92 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.557 -0.715 . . . . 2.0 110.63 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.66 -39.88 85.9 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.533 -0.73 . . . . 2.22 110.988 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.07 -44.57 68.86 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 1.46 110.589 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.507 HG21 ' CD ' ' A' ' 20' ' ' LYS . 96.9 t -68.6 -48.56 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.713 -0.617 . . . . 0.65 110.256 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.5 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.9 m-20 -60.04 -49.49 77.45 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.509 -0.744 . . . . 1.33 111.503 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.44 -47.77 84.21 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.14 -0.975 . . . . 0.46 110.427 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -64.76 -41.13 96.13 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 120.296 -0.561 . . . . 0.39 110.803 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.07 -37.13 79.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 N-CA-C 108.257 -1.016 . . . . 0.57 108.257 179.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -60.24 -40.08 88.99 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.924 -0.769 . . . . 2.82 108.924 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.37 -50.68 72.64 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.883 -0.511 . . . . 1.73 110.219 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.483 HD12 ' C ' ' A' ' 36' ' ' LEU . 0.1 OUTLIER -60.21 -38.42 83.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.605 -0.684 . . . . 1.53 109.669 179.431 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.57 HD23 ' HE2' ' A' ' 40' ' ' LYS . 12.7 mt -58.0 -41.31 82.79 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.541 -0.724 . . . . 1.36 109.986 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.8 m -60.27 -39.98 88.75 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.577 -0.702 . . . . 1.31 109.326 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.414 HD13 ' HG2' ' A' ' 8' ' ' ARG . 43.2 mt -67.82 -43.21 80.12 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.007 -0.677 . . . . 0.72 109.279 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.57 ' HE2' HD23 ' A' ' 37' ' ' LEU . 36.5 ttpt -60.01 -39.19 84.96 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.74 -0.6 . . . . 2.38 109.921 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.59 -42.16 91.93 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.262 -0.575 . . . . 0.69 110.453 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.14 -41.39 98.22 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.332 -0.855 . . . . 1.9 109.875 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -40.46 89.58 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-O 121.953 0.882 . . . . 2.03 109.541 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -60.03 -34.17 73.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.905 -0.497 . . . . 2.12 111.177 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -56.1 -40.01 73.01 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.563 -0.711 . . . . 2.41 111.834 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -62.2 -57.83 10.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.085 -1.009 . . . . 2.31 111.329 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.3 m -156.21 25.16 0.36 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.135 -0.978 . . . . 2.51 111.155 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.95 36.27 64.95 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 110.607 -0.997 . . . . 1.86 110.607 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -85.18 -15.85 42.34 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.402 -1.058 . . . . 2.7 111.43 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 38.05 -166.37 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 113.009 0.744 . . . . 2.37 113.009 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.4 ' CD1' HG22 ' A' ' 9' ' ' VAL . 45.3 t80 -71.83 105.09 3.66 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.184 -0.948 . . . . 2.77 110.207 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.7 mmtm -69.13 136.93 89.27 Favored Pre-proline 0 N--CA 1.493 1.697 0 N-CA-C 108.624 -0.88 . . . . 5.01 108.624 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -71.35 -177.47 2.41 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 O-C-N 123.159 1.084 . . . . 3.45 111.102 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 72.7 16.25 77.87 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 111.206 -0.758 . . . . 3.07 111.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 54.25 177.71 0.03 OUTLIER Pre-proline 0 N--CA 1.505 2.306 0 O-C-N 121.005 -1.291 . . . . 4.09 110.657 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.99 150.02 66.22 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.107 1.056 . . . . 4.1 110.463 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo . . . . . 0 C--N 1.318 -1.041 0 O-C-N 123.582 1.306 . . . . 4.82 110.829 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 46.0 t0 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.878 0.371 . . . . 3.98 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.426 ' HB3' HD12 ' A' ' 5' ' ' LEU . 10.7 m -71.33 60.8 0.31 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.478 -0.764 . . . . 1.95 110.346 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tp -66.43 -40.0 89.25 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.563 -0.711 . . . . 1.69 110.393 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 86.9 t -59.95 -45.53 95.13 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.68 -0.638 . . . . 1.52 110.655 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.426 HD12 ' HB3' ' A' ' 2' ' ' SER . 86.9 mt -59.96 -39.95 87.35 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.374 -0.829 . . . . 1.92 109.868 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' A' ' 51' ' ' TYR . 2.5 m-85 -57.63 -38.54 75.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.685 -0.634 . . . . 3.87 109.947 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.816 ' O ' HG23 ' A' ' 11' ' ' VAL . 96.3 m-20 -60.05 -40.02 88.0 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.585 -0.697 . . . . 1.35 110.315 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 mtp85 -59.97 -50.99 71.59 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.373 -0.83 . . . . 2.93 110.886 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.783 ' HA ' HD13 ' A' ' 39' ' ' LEU . 25.1 m -69.54 -38.09 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 N-CA-C 108.238 -1.023 . . . . 1.07 108.238 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.458 ' HB2' ' HD3' ' A' ' 56' ' ' PRO . . . -60.07 -39.33 85.66 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 116.098 -0.501 . . . . 0.42 110.543 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.6 t -60.03 -50.02 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.378 -0.826 . . . . 0.95 109.96 -179.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.44 -50.22 74.45 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.151 -0.968 . . . . 1.84 109.392 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.67 -55.49 3.23 Favored Glycine 0 N--CA 1.507 3.388 0 N-CA-C 110.143 -1.183 . . . . 0.36 110.143 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -65.0 -35.61 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.934 -0.745 . . . . 1.12 110.854 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 11' ' ' VAL . 86.0 t -60.01 -40.0 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.193 0 O-C-N 121.263 -0.898 . . . . 0.46 109.666 -179.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.02 -49.0 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 N-CA-C 108.902 -0.777 . . . . 0.7 108.902 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 58.8 ttp85 -60.32 -43.12 96.67 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.866 -0.521 . . . . 3.15 110.444 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -63.99 -41.7 97.42 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.41 -0.806 . . . . 2.23 111.406 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 74.9 mt -60.76 -40.51 92.74 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.42 -0.8 . . . . 1.02 110.424 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' CD ' HG21 ' A' ' 29' ' ' VAL . 39.7 tptt -67.2 -40.09 86.43 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 109.127 -0.694 . . . . 2.08 109.127 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.46 -26.26 66.63 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.739 -0.837 . . . . 0.81 108.739 178.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -86.22 9.18 18.38 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.725 -0.609 . . . . 2.11 110.391 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 56.7 21.37 5.83 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.279 -0.888 . . . . 2.28 111.073 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.443 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -59.24 163.56 5.99 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.586 -0.696 . . . . 0.71 109.933 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.443 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 42.3 Cg_endo -67.82 162.32 40.08 Favored 'Trans proline' 0 C--N 1.314 -1.253 0 O-C-N 123.484 1.255 . . . . 0.93 111.292 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -55.28 -27.4 46.42 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.754 -0.591 . . . . 2.0 110.258 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -58.66 -40.0 82.2 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.62 -0.675 . . . . 2.22 110.461 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -71.15 -45.35 63.71 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.403 -0.81 . . . . 1.46 110.869 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.507 HG21 ' CD ' ' A' ' 20' ' ' LYS . 82.5 t -68.55 -50.0 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.497 -0.752 . . . . 0.65 110.164 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.445 ' O ' HG12 ' A' ' 33' ' ' VAL . 71.4 m-20 -59.98 -46.16 90.34 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.727 -0.608 . . . . 1.33 110.871 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.39 82.03 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.255 -0.903 . . . . 0.46 110.404 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.15 -42.26 89.28 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 120.086 -0.645 . . . . 0.39 110.496 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.505 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -65.93 -39.58 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 N-CA-C 108.358 -0.978 . . . . 0.57 108.358 179.331 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -61.06 -42.28 98.19 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.997 -1.112 . . . . 2.82 107.997 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -65.32 -42.45 92.98 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.833 -1.173 . . . . 1.73 107.833 178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.505 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 15.4 tp -60.03 -46.63 88.89 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.737 -0.665 . . . . 1.53 110.0 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.3 mt -59.42 -38.4 80.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.272 -0.892 . . . . 1.36 109.575 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 38.3 t -59.74 -34.51 73.04 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.644 . . . . 1.31 109.633 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.783 HD13 ' HA ' ' A' ' 9' ' ' VAL . 93.0 mt -60.0 -48.91 79.76 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.473 -0.767 . . . . 0.72 109.5 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.93 -39.93 91.28 Favored 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.774 0.797 . . . . 2.38 109.109 178.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -43.97 94.85 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 116.177 -0.465 . . . . 0.69 110.566 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -59.97 -50.68 72.81 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.302 -0.874 . . . . 1.9 109.655 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.421 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -64.47 -38.28 90.46 Favored 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.814 0.816 . . . . 2.03 109.718 178.591 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.9 tttp -60.0 -39.05 84.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.928 -0.483 . . . . 2.12 111.815 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -54.86 -39.03 68.21 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.386 -0.821 . . . . 2.41 112.003 -178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -62.58 -60.01 4.13 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.009 -1.057 . . . . 2.31 111.325 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.9 m -156.26 23.47 0.36 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.287 -0.883 . . . . 2.51 110.876 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.04 63.11 3.6 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 109.385 -1.486 . . . . 1.86 109.385 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 95.7 mm-40 -83.82 -41.5 17.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.495 -1.003 . . . . 2.7 111.823 -179.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 8.0 pt-20 33.54 92.14 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.86 0 CA-C-O 121.584 0.706 . . . . 2.37 112.113 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.406 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 53.3 p90 -51.04 154.1 1.65 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.107 -0.995 . . . . 2.77 111.248 -178.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.02 153.99 52.45 Favored Pre-proline 0 N--CA 1.498 1.935 0 O-C-N 121.603 -0.686 . . . . 5.01 110.465 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -74.26 -17.13 21.83 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.393 1.207 . . . . 3.45 111.717 -178.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.85 33.01 3.6 Favored Glycine 0 N--CA 1.497 2.703 0 C-N-CA 119.825 -1.179 . . . . 3.07 112.056 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.414 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 2.1 m-20 54.62 177.35 0.03 OUTLIER Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 120.901 -1.352 . . . . 4.09 110.868 178.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.458 ' HD3' ' HB2' ' A' ' 10' ' ' ALA . 37.5 Cg_endo -69.96 150.04 66.42 Favored 'Trans proline' 0 N--CA 1.487 1.14 0 O-C-N 123.408 1.215 . . . . 4.1 111.193 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 C--N 1.319 -1.013 0 O-C-N 123.586 1.309 . . . . 4.82 110.285 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.464 -0.569 . . . . 3.98 109.464 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.1 m -71.42 58.49 0.27 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.448 -0.782 . . . . 1.95 110.302 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 54.0 tp -65.13 -41.32 94.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.452 -0.78 . . . . 1.69 109.113 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.464 HG13 ' N ' ' A' ' 5' ' ' LEU . 9.9 p -58.02 -40.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 121.354 0.597 . . . . 1.52 110.531 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.464 ' N ' HG13 ' A' ' 4' ' ' VAL . 8.0 tt -60.02 -40.72 90.28 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.373 0.606 . . . . 1.92 110.183 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -59.52 -40.11 86.09 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.888 -0.508 . . . . 3.87 110.369 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.779 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.1 m-20 -63.21 -40.41 97.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.369 -0.832 . . . . 1.35 110.259 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -62.42 -49.63 74.71 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.13 -0.981 . . . . 2.93 112.106 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.933 HG12 ' HB3' ' A' ' 39' ' ' LEU . 26.6 m -64.83 -42.81 95.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.02 -1.05 . . . . 1.07 110.654 -179.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.454 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -62.24 -40.76 97.24 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.39 -0.819 . . . . 0.42 111.689 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.779 HG23 ' O ' ' A' ' 7' ' ' ASN . 73.5 t -60.09 -47.68 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.454 -0.779 . . . . 0.95 111.132 -177.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HG3' HD11 ' A' ' 39' ' ' LEU . 30.0 mm100 -60.61 -48.17 82.95 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 119.245 -0.982 . . . . 1.84 109.553 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -38.6 -56.81 1.97 Allowed Glycine 0 N--CA 1.511 3.688 0 N-CA-C 110.175 -1.17 . . . . 0.36 110.175 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.58 -38.49 91.33 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.977 -0.719 . . . . 1.12 111.004 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 11' ' ' VAL . 93.1 t -59.87 -44.4 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.816 . . . . 0.46 109.427 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.548 HG22 ' CB ' ' A' ' 32' ' ' ALA . 63.9 t -59.98 -44.99 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 N-CA-C 108.386 -0.968 . . . . 0.7 108.386 177.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 52.2 mtm180 -60.45 -41.57 94.35 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.875 -0.515 . . . . 3.15 111.069 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -64.16 -44.51 91.86 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.345 -0.847 . . . . 2.23 111.445 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -61.32 -41.96 97.88 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.536 -0.727 . . . . 1.02 111.097 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.463 ' CD ' HG21 ' A' ' 29' ' ' VAL . 39.3 tptt -63.93 -40.02 95.49 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.361 -0.837 . . . . 2.08 108.993 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.8 67.22 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.58 -0.896 . . . . 0.81 108.58 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 66.0 mttm -84.37 7.38 19.7 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.729 -0.607 . . . . 2.11 110.852 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 25.9 mmtp 59.28 20.14 8.29 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.172 -0.955 . . . . 2.28 110.938 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.76 162.3 9.6 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.613 -0.68 . . . . 0.71 109.822 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.2 166.48 28.0 Favored 'Trans proline' 0 C--N 1.314 -1.237 0 O-C-N 123.33 1.174 . . . . 0.93 111.133 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.1 -26.87 51.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.747 -0.596 . . . . 2.0 111.005 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.6 -40.04 86.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.478 -0.763 . . . . 2.22 110.557 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -72.45 -45.93 57.33 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 1.46 110.933 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.463 HG21 ' CD ' ' A' ' 20' ' ' LYS . 88.8 t -63.89 -49.89 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 O-C-N 121.498 -0.751 . . . . 0.65 109.461 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -60.0 -44.92 94.24 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.742 -0.599 . . . . 1.33 111.025 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -50.03 75.28 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.405 -0.809 . . . . 0.46 110.564 -179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.548 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -63.38 -45.92 88.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.659 -0.651 . . . . 0.39 110.21 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -35.63 75.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.28 -1.007 . . . . 0.57 108.28 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -59.94 -43.93 94.68 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 108.45 -0.944 . . . . 2.82 108.45 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? -64.37 -47.44 79.28 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.356 -0.979 . . . . 1.73 108.356 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 tp -59.95 -40.4 88.87 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 115.613 -0.722 . . . . 1.53 110.032 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.6 mt -59.56 -37.41 78.4 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.538 -0.726 . . . . 1.36 109.919 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.7 m -59.84 -40.11 87.42 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.556 -0.715 . . . . 1.31 109.522 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.933 ' HB3' HG12 ' A' ' 9' ' ' VAL . 54.7 mt -63.95 -54.84 28.24 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 109.036 -0.727 . . . . 0.72 109.036 179.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.85 -34.65 74.9 Favored 'General case' 0 N--CA 1.495 1.797 0 CA-C-O 121.565 0.698 . . . . 2.38 109.404 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.454 ' HA ' ' HG2' ' A' ' 44' ' ' LYS . . . -59.88 -38.78 83.19 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.845 -0.535 . . . . 0.69 110.299 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.64 -40.82 84.59 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.24 -0.913 . . . . 1.9 109.884 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -60.39 -45.93 91.8 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.584 -0.698 . . . . 2.03 111.389 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 41' ' ' ALA . 1.0 OUTLIER -61.38 -19.12 61.52 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.327 -0.858 . . . . 2.12 112.034 -178.487 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -59.35 -39.98 84.96 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.365 -0.834 . . . . 2.41 110.745 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.23 -57.42 10.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.575 -0.703 . . . . 2.31 111.092 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.555 ' O ' HG22 ' A' ' 47' ' ' THR . 40.2 m -151.51 19.29 0.73 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.236 -0.915 . . . . 2.51 110.776 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.4 39.31 80.68 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.656 -1.378 . . . . 1.86 109.656 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 50' ' ' GLU . 96.6 mm-40 -90.2 -15.39 31.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.606 -0.937 . . . . 2.7 112.2 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' O ' ' O ' ' A' ' 49' ' ' GLN . 14.8 pt-20 39.75 -176.33 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.608 0 N-CA-C 113.274 0.842 . . . . 2.37 113.274 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -75.27 70.74 2.22 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.944 -1.098 . . . . 2.77 110.724 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.6 mttp -68.4 150.61 97.64 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.174 -0.954 . . . . 5.01 109.278 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -69.78 -58.3 0.1 Allowed 'Trans proline' 0 C--N 1.318 -1.034 0 O-C-N 123.23 1.121 . . . . 3.45 110.305 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -82.83 48.85 4.09 Favored Glycine 0 N--CA 1.49 2.247 0 C-N-CA 119.517 -1.325 . . . . 3.07 110.227 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -143.75 59.45 7.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.291 -1.123 . . . . 4.09 110.222 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -69.98 150.01 66.26 Favored 'Trans proline' 0 N--CA 1.489 1.229 0 O-C-N 123.743 1.391 . . . . 4.1 110.542 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 C--N 1.318 -1.075 0 O-C-N 123.306 1.161 . . . . 4.82 110.413 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.065 0.46 . . . . 3.98 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.1 m -64.12 -40.92 97.23 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.585 -0.697 . . . . 1.95 110.71 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.6 tp -62.42 -42.4 99.42 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.509 -0.744 . . . . 1.69 109.807 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.75 -46.66 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 C-N-CA 120.441 -0.503 . . . . 1.52 109.872 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.73 -42.51 93.31 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.313 -0.867 . . . . 1.92 109.343 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.495 ' O ' HG22 ' A' ' 9' ' ' VAL . 4.5 t80 -59.89 -39.93 87.02 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.67 -0.644 . . . . 3.87 110.15 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.733 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.5 m-20 -60.03 -39.98 87.76 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.29 -0.882 . . . . 1.35 110.286 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -59.99 -47.3 86.37 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.689 -0.632 . . . . 2.93 110.892 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.885 ' HA ' HD13 ' A' ' 39' ' ' LEU . 33.1 m -69.12 -39.97 80.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.122 -0.986 . . . . 1.07 109.434 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.629 ' HB2' ' HD3' ' A' ' 56' ' ' PRO . . . -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.527 -0.733 . . . . 0.42 110.486 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 7' ' ' ASN . 52.4 t -59.96 -49.04 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 121.737 -0.602 . . . . 0.95 110.756 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.508 ' CB ' HD11 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -60.02 -50.09 75.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.479 -0.763 . . . . 1.84 109.577 -179.371 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.645 ' HA2' HD13 ' A' ' 36' ' ' LEU . . . -41.93 -55.01 4.23 Favored Glycine 0 N--CA 1.507 3.368 0 N-CA-C 110.49 -1.044 . . . . 0.36 110.49 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -63.34 -35.26 79.79 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.844 -0.797 . . . . 1.12 111.923 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 11' ' ' VAL . 72.5 t -59.99 -43.58 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.23 -0.919 . . . . 0.46 109.828 -178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.687 HG11 HG23 ' A' ' 33' ' ' VAL . 62.5 t -59.99 -44.53 94.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.457 -0.777 . . . . 0.7 109.597 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -60.02 -40.0 87.78 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.675 -0.641 . . . . 3.15 110.806 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.01 -44.03 94.82 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.441 -0.787 . . . . 2.23 111.414 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.495 HD23 ' HB3' ' A' ' 28' ' ' ASP . 4.6 mp -59.96 -39.99 87.52 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.328 -0.858 . . . . 1.02 110.337 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.594 ' CD ' HG21 ' A' ' 29' ' ' VAL . 10.7 tptt -62.58 -39.97 95.38 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 109.196 -0.668 . . . . 2.08 109.196 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.3 -25.48 67.14 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.583 -0.895 . . . . 0.81 108.583 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.29 6.86 24.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.747 -0.596 . . . . 2.11 110.399 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 55.41 25.82 8.11 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.231 -0.918 . . . . 2.28 110.812 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.601 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -58.47 170.33 0.81 Allowed Pre-proline 0 N--CA 1.498 1.951 0 O-C-N 121.761 -0.587 . . . . 0.71 110.061 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.601 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 45.4 Cg_endo -71.26 154.85 61.42 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.33 1.174 . . . . 0.93 110.012 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -54.47 -24.79 21.78 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.36 -0.837 . . . . 2.0 111.159 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.521 -0.737 . . . . 2.22 110.438 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.495 ' HB3' HD23 ' A' ' 19' ' ' LEU . 68.4 m-20 -72.6 -46.44 54.23 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.457 -0.777 . . . . 1.46 110.974 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.594 HG21 ' CD ' ' A' ' 20' ' ' LYS . 97.8 t -66.04 -49.72 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.648 -0.657 . . . . 0.65 110.608 -179.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.478 ' O ' HG12 ' A' ' 33' ' ' VAL . 75.1 m-20 -59.93 -50.92 71.87 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.388 -0.82 . . . . 1.33 111.625 -179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.46 90.02 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.038 -1.039 . . . . 0.46 110.399 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.5 ' HB1' HG22 ' A' ' 16' ' ' VAL . . . -65.3 -39.98 93.19 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 120.319 -0.552 . . . . 0.39 110.766 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.687 HG23 HG11 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -68.45 -38.89 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.217 -0.927 . . . . 0.57 109.26 179.594 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -60.0 -35.29 74.72 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.754 0.788 . . . . 2.82 109.113 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -59.95 -40.05 87.66 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.408 0.623 . . . . 1.73 109.587 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.645 HD13 ' HA2' ' A' ' 13' ' ' GLY . 35.3 mt -59.25 -40.03 84.69 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 120.115 -0.634 . . . . 1.53 109.706 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.499 HD12 ' N ' ' A' ' 37' ' ' LEU . 9.7 mp -58.99 -34.67 72.1 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.477 -0.764 . . . . 1.36 109.619 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.546 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 26.6 t -59.96 -39.98 87.46 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.903 -0.777 . . . . 1.31 108.903 178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.885 HD13 ' HA ' ' A' ' 9' ' ' VAL . 92.2 mt -59.95 -49.98 75.53 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 108.629 -0.878 . . . . 0.72 108.629 178.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -62.2 -33.03 73.77 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.916 -0.772 . . . . 2.38 108.916 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 38' ' ' SER . . . -60.03 -43.01 95.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.7 -0.625 . . . . 0.69 109.748 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -61.26 -44.22 97.6 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.231 -1.026 . . . . 1.9 108.231 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.61 -41.2 94.34 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-O 121.545 0.688 . . . . 2.03 109.859 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -60.0 -36.35 77.0 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.714 -0.616 . . . . 2.12 111.486 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -56.27 -40.02 73.58 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.322 -0.861 . . . . 2.41 110.745 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -68.09 -62.83 1.23 Allowed 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.701 -0.8 . . . . 2.31 110.795 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.2 t -165.78 29.39 0.05 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.303 -0.873 . . . . 2.51 111.613 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.05 63.87 3.42 Favored Glycine 0 N--CA 1.497 2.742 0 N-CA-C 109.136 -1.586 . . . . 1.86 109.136 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 99.6 mt-30 -83.11 -32.15 26.89 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.656 -0.909 . . . . 2.7 110.462 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 15.2 pt-20 32.31 98.48 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 113.38 0.881 . . . . 2.37 113.38 179.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -56.49 139.98 47.54 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.148 -0.97 . . . . 2.77 110.513 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttp -68.65 159.41 81.93 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.66 -0.65 . . . . 5.01 110.694 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.66 -4.82 16.0 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 O-C-N 123.467 1.246 . . . . 3.45 111.435 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -82.49 9.59 58.11 Favored Glycine 0 N--CA 1.496 2.665 0 C-N-CA 119.864 -1.16 . . . . 3.07 111.478 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.485 ' ND2' ' HB1' ' A' ' 10' ' ' ALA . 1.1 m120 56.6 174.5 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.07 0 O-C-N 120.896 -1.355 . . . . 4.09 110.77 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.629 ' HD3' ' HB2' ' A' ' 10' ' ' ALA . 38.1 Cg_endo -69.99 150.02 66.22 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.55 1.289 . . . . 4.1 110.68 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo . . . . . 0 C--N 1.318 -1.077 0 O-C-N 123.565 1.297 . . . . 4.82 110.605 -179.355 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 50.7 p-10 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 120.979 0.418 . . . . 3.98 110.321 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.3 m -71.38 59.44 0.28 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.522 -0.736 . . . . 1.95 110.507 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 19.8 tp -61.81 -44.35 97.03 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.659 0.742 . . . . 1.69 109.82 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 98.0 t -60.03 -41.93 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.928 -0.483 . . . . 1.52 111.146 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -59.98 -47.97 83.65 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.317 -0.864 . . . . 1.92 110.149 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.463 ' O ' HG22 ' A' ' 9' ' ' VAL . 8.1 m-85 -57.42 -38.31 74.16 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.522 -0.736 . . . . 3.87 110.418 179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.741 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.6 m-20 -60.01 -40.08 88.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.522 -0.736 . . . . 1.35 110.563 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -60.02 -48.89 79.83 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.457 -0.777 . . . . 2.93 110.835 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.848 HG12 ' HB3' ' A' ' 39' ' ' LEU . 30.6 m -65.77 -39.92 86.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 C-N-CA 119.327 -0.949 . . . . 1.07 109.715 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -40.54 98.06 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.493 -0.754 . . . . 0.42 110.55 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.741 HG23 ' O ' ' A' ' 7' ' ' ASN . 65.8 t -60.66 -42.72 92.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.655 -0.653 . . . . 0.95 110.777 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -62.89 -56.44 17.29 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.132 -0.98 . . . . 1.84 109.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -37.71 -52.74 1.93 Allowed Glycine 0 N--CA 1.512 3.763 0 N-CA-C 110.717 -0.953 . . . . 0.36 110.717 -178.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -61.71 -38.73 88.94 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.976 -0.72 . . . . 1.12 110.941 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 11' ' ' VAL . 97.7 t -59.96 -40.18 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.324 -0.86 . . . . 0.46 110.023 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.416 HG22 ' HB3' ' A' ' 32' ' ' ALA . 71.8 t -60.04 -49.96 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 O-C-N 121.024 -1.047 . . . . 0.7 108.805 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 68.1 ttt-85 -60.07 -44.44 94.75 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 121.459 0.647 . . . . 3.15 110.167 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.14 -48.31 82.26 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.81 -0.556 . . . . 2.23 110.737 -179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.97 -46.07 90.62 Favored 'General case' 0 N--CA 1.497 1.879 0 C-N-CA 120.043 -0.663 . . . . 1.02 110.105 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -66.31 -39.99 89.65 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.414 -0.958 . . . . 2.08 108.414 179.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.73 -30.55 70.84 Favored 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 108.675 -0.861 . . . . 0.81 108.675 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -85.6 10.72 12.43 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 120.44 -0.504 . . . . 2.11 110.873 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt 59.91 20.14 9.13 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.302 -0.874 . . . . 2.28 111.195 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -59.4 165.19 4.18 Favored Pre-proline 0 N--CA 1.497 1.918 0 O-C-N 121.554 -0.716 . . . . 0.71 109.953 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 45.3 Cg_endo -70.61 160.55 49.08 Favored 'Trans proline' 0 N--CA 1.488 1.2 0 O-C-N 123.32 1.168 . . . . 0.93 111.349 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.497 ' HA ' HG12 ' A' ' 29' ' ' VAL . 33.9 mtpt -55.83 -25.71 43.12 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.574 -0.704 . . . . 2.0 110.446 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -59.98 -39.91 87.3 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.152 -0.968 . . . . 2.22 109.953 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -70.0 -49.63 49.57 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.437 -0.789 . . . . 1.46 111.42 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.497 HG12 ' HA ' ' A' ' 26' ' ' LYS . 8.4 p -65.05 -43.25 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.406 -0.809 . . . . 0.65 110.221 -179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.434 ' O ' HG12 ' A' ' 33' ' ' VAL . 95.6 m-20 -60.03 -41.75 92.89 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.8 -0.562 . . . . 1.33 110.792 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.64 -50.11 72.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.447 -0.783 . . . . 0.46 110.797 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -65.46 -41.52 93.3 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 120.182 -0.607 . . . . 0.39 110.331 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.46 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -67.12 -38.87 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 107.412 -1.329 . . . . 0.57 107.412 178.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -60.43 -46.36 90.33 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.342 -0.984 . . . . 2.82 108.342 177.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -64.23 -40.92 97.04 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.095 -1.076 . . . . 1.73 108.095 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.598 ' HA ' HD12 ' A' ' 39' ' ' LEU . 17.2 tp -60.0 -40.33 88.84 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 115.626 -0.715 . . . . 1.53 110.322 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.54 HD23 ' HD3' ' A' ' 40' ' ' LYS . 77.5 mt -59.96 -40.0 87.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.219 -0.926 . . . . 1.36 109.722 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 71.3 m -60.44 -37.02 79.61 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.424 -0.798 . . . . 1.31 109.347 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.848 ' HB3' HG12 ' A' ' 9' ' ' VAL . 88.6 mt -59.98 -56.24 24.1 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.672 -0.643 . . . . 0.72 110.439 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.54 ' HD3' HD23 ' A' ' 37' ' ' LEU . 17.6 ptmt -62.11 -35.88 80.06 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.317 -0.865 . . . . 2.38 109.23 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -60.76 -43.77 97.58 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 116.112 -0.495 . . . . 0.69 110.488 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -60.04 -47.6 85.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.111 -0.993 . . . . 1.9 109.259 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.464 ' CE2' ' HB3' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -61.22 -38.7 87.54 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.498 -0.751 . . . . 2.03 109.042 178.081 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 40.8 ttpt -60.34 -27.27 67.23 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.749 -0.594 . . . . 2.12 111.081 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -55.6 -37.76 68.55 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.26 -0.9 . . . . 2.41 110.961 -179.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -62.82 -77.71 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.443 -0.786 . . . . 2.31 110.014 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 t -161.49 40.44 0.14 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.31 -0.869 . . . . 2.51 110.241 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.71 65.75 2.4 Favored Glycine 0 N--CA 1.496 2.698 0 N-CA-C 109.972 -1.251 . . . . 1.86 109.972 -179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HB3' ' CE2' ' A' ' 43' ' ' TYR . 81.6 mm-40 -86.43 -21.75 26.92 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.467 -1.019 . . . . 2.7 111.608 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 9.0 pt-20 32.21 92.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 112.811 0.671 . . . . 2.37 112.811 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -57.7 138.43 55.45 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.126 -0.984 . . . . 2.77 110.716 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.4 ' HB2' ' HD2' ' A' ' 56' ' ' PRO . 18.1 mmtt -65.12 166.32 13.41 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.669 -0.645 . . . . 5.01 109.414 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -62.24 -33.72 80.26 Favored 'Trans proline' 0 C--N 1.315 -1.207 0 O-C-N 123.125 1.066 . . . . 3.45 111.228 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.86 -3.08 89.15 Favored Glycine 0 N--CA 1.493 2.495 0 C-N-CA 119.313 -1.423 . . . . 3.07 110.665 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.415 ' N ' ' CD ' ' A' ' 56' ' ' PRO . 69.3 m-80 49.52 49.94 8.3 Favored Pre-proline 0 N--CA 1.506 2.348 0 O-C-N 121.047 -1.266 . . . . 4.09 111.656 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.418 ' O ' ' CZ ' ' A' ' 6' ' ' TYR . 37.2 Cg_endo -70.05 149.97 65.8 Favored 'Trans proline' 0 N--CA 1.487 1.112 0 O-C-N 123.166 1.087 . . . . 4.1 110.991 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 N--CA 1.488 1.174 0 O-C-N 123.417 1.22 . . . . 4.82 110.616 179.256 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.426 ' O ' HG12 ' A' ' 4' ' ' VAL . 78.2 m-20 . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.374 0.607 . . . . 3.98 110.004 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m -66.99 -39.96 87.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.39 -0.819 . . . . 1.95 110.682 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.509 HD23 ' C ' ' A' ' 3' ' ' LEU . 7.9 tt -61.2 -50.95 71.05 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.485 -0.76 . . . . 1.69 112.474 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 5' ' ' LEU . 14.7 p -58.64 -39.5 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.148 0 O-C-N 121.089 -1.007 . . . . 1.52 110.251 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.612 HD12 ' CZ ' ' A' ' 43' ' ' TYR . 0.5 OUTLIER -58.93 -39.96 83.18 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 109.394 -0.595 . . . . 1.92 109.394 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.56 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 m-85 -59.11 -38.26 79.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.614 -0.679 . . . . 3.87 110.103 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.836 ' O ' HG23 ' A' ' 11' ' ' VAL . 58.9 m-20 -60.04 -40.75 90.48 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.14 -0.975 . . . . 1.35 109.938 -179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 ttp180 -60.01 -49.52 77.32 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.762 -0.586 . . . . 2.93 110.715 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.861 HG12 ' HB3' ' A' ' 39' ' ' LEU . 26.5 m -66.76 -39.46 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.391 -0.818 . . . . 1.07 109.565 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.685 ' HB1' ' OD1' ' A' ' 55' ' ' ASN . . . -60.51 -37.1 80.03 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.534 -0.728 . . . . 0.42 110.319 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.836 HG23 ' O ' ' A' ' 7' ' ' ASN . 64.2 t -60.01 -49.95 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.625 -0.672 . . . . 0.95 109.76 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.37 -56.13 21.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.353 -0.842 . . . . 1.84 109.876 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -36.42 -52.5 1.35 Allowed Glycine 0 N--CA 1.514 3.866 0 N-CA-C 110.907 -0.877 . . . . 0.36 110.907 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -62.26 -37.93 87.33 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.884 -0.774 . . . . 1.12 111.289 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 11' ' ' VAL . 76.2 t -59.52 -40.56 82.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.329 -0.857 . . . . 0.46 109.469 -178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.1 t -59.98 -49.6 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.4 -0.812 . . . . 0.7 109.004 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -60.0 -43.48 95.19 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.581 -0.699 . . . . 3.15 110.423 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -60.4 -39.5 87.57 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.481 -0.762 . . . . 2.23 111.255 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.478 HD22 ' HB3' ' A' ' 28' ' ' ASP . 83.1 mt -60.02 -40.5 89.54 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.374 -0.829 . . . . 1.02 110.924 -178.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.522 ' HE2' HG21 ' A' ' 29' ' ' VAL . 14.3 mmtp -66.24 -40.26 90.1 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.35 -0.844 . . . . 2.08 109.326 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.53 -27.39 66.93 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.171 -1.048 . . . . 0.81 108.171 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 48.7 mtpt -86.33 9.44 17.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.715 -0.616 . . . . 2.11 111.007 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 57.9 mtpt 58.08 24.77 11.6 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.28 -0.888 . . . . 2.28 110.822 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 157.99 40.65 Favored Pre-proline 0 N--CA 1.497 1.914 0 O-C-N 121.777 -0.577 . . . . 0.71 110.3 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.52 167.44 27.03 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.433 1.228 . . . . 0.93 110.478 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -56.63 -31.86 64.76 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.732 -0.605 . . . . 2.0 109.778 179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -59.71 -40.05 86.66 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.637 -0.664 . . . . 2.22 110.533 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.478 ' HB3' HD22 ' A' ' 19' ' ' LEU . 63.1 m-20 -69.81 -42.45 73.69 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.291 -0.881 . . . . 1.46 110.049 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.522 HG21 ' HE2' ' A' ' 20' ' ' LYS . 93.8 t -67.68 -48.95 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 CA-C-O 121.39 0.614 . . . . 0.65 109.773 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' O ' HG12 ' A' ' 33' ' ' VAL . 89.1 m-20 -59.92 -46.87 87.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.658 -0.652 . . . . 1.33 111.198 -179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.29 -47.72 84.69 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.333 -0.855 . . . . 0.46 110.758 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.75 -44.99 88.32 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.497 -0.752 . . . . 0.39 110.247 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.444 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -64.47 -38.51 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 108.031 -1.1 . . . . 0.57 108.031 178.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -60.06 -45.5 92.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 108.07 -1.085 . . . . 2.82 108.07 177.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -63.57 -43.15 97.84 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-O 122.117 0.961 . . . . 1.73 108.604 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 17.4 tp -59.96 -42.44 94.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 115.833 -0.621 . . . . 1.53 110.096 179.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.03 -38.72 83.55 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.499 -0.75 . . . . 1.36 110.384 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.2 p -59.98 -37.57 80.03 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.365 -0.835 . . . . 1.31 109.337 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.861 ' HB3' HG12 ' A' ' 9' ' ' VAL . 79.7 mt -62.23 -52.93 61.8 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.609 -0.886 . . . . 0.72 108.609 178.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.58 -38.37 84.37 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.42 0.629 . . . . 2.38 109.361 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.39 93.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.757 -0.59 . . . . 0.69 109.762 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -60.08 -44.9 94.43 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.617 -0.882 . . . . 1.9 108.617 178.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.612 ' CZ ' HD12 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -60.19 -43.34 95.98 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 121.433 0.635 . . . . 2.03 110.101 178.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.54 -29.03 68.88 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.722 -0.611 . . . . 2.12 111.793 -179.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -55.97 -39.97 72.58 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.288 -0.882 . . . . 2.41 111.212 -178.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -68.31 -64.39 0.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.397 -0.815 . . . . 2.31 110.79 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.9 t -165.94 32.79 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.383 -0.823 . . . . 2.51 110.994 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.59 70.58 1.2 Allowed Glycine 0 N--CA 1.498 2.788 0 N-CA-C 110.398 -1.081 . . . . 1.86 110.398 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 50' ' ' GLU . 60.6 mm-40 -85.92 -28.01 24.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.537 -0.978 . . . . 2.7 110.405 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.492 ' O ' ' O ' ' A' ' 49' ' ' GLN . 16.2 pt-20 39.47 114.98 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.554 0 CA-C-O 122.892 1.33 . . . . 2.37 113.088 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.572 ' CD1' HG23 ' A' ' 9' ' ' VAL . 13.9 t80 -55.9 131.47 47.15 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.844 -1.16 . . . . 2.77 110.668 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.5 mmtm -69.55 154.51 94.76 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.771 -0.58 . . . . 5.01 109.488 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -80.34 -20.2 8.54 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.344 1.181 . . . . 3.45 111.55 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.05 32.57 3.76 Favored Glycine 0 N--CA 1.497 2.722 0 C-N-CA 119.87 -1.157 . . . . 3.07 112.4 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.685 ' OD1' ' HB1' ' A' ' 10' ' ' ALA . 1.3 m-20 55.52 179.91 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 120.73 -1.453 . . . . 4.09 110.089 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.429 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 38.1 Cg_endo -70.0 149.99 66.15 Favored 'Trans proline' 0 N--CA 1.487 1.111 0 O-C-N 123.148 1.078 . . . . 4.1 109.666 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 C--N 1.317 -1.106 0 O-C-N 123.255 1.134 . . . . 4.82 110.511 -179.763 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.115 0.483 . . . . 3.98 110.266 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.5 t -65.53 -46.33 80.01 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.539 -0.726 . . . . 1.95 110.662 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.469 HD11 ' HG2' ' A' ' 57' ' ' PRO . 37.5 tp -64.77 -52.65 55.83 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.503 -0.748 . . . . 1.69 110.845 -179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.493 HG13 ' N ' ' A' ' 5' ' ' LEU . 11.9 p -59.56 -46.36 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.59 -0.694 . . . . 1.52 110.904 -178.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.493 ' N ' HG13 ' A' ' 4' ' ' VAL . 85.0 mt -61.38 -40.03 92.83 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.346 -0.846 . . . . 1.92 109.404 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.492 ' O ' HG22 ' A' ' 9' ' ' VAL . 32.3 t80 -59.93 -39.85 86.93 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.045 -0.724 . . . . 3.87 109.045 178.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.832 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.6 m-20 -60.14 -39.88 87.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.408 -0.807 . . . . 1.35 109.995 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -58.94 -49.97 75.82 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.382 -0.824 . . . . 2.93 110.431 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.861 HG12 ' HB3' ' A' ' 39' ' ' LEU . 28.0 m -68.43 -38.19 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.156 -0.965 . . . . 1.07 108.626 178.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.643 ' HB1' ' HD3' ' A' ' 56' ' ' PRO . . . -59.98 -38.15 81.71 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.745 -0.597 . . . . 0.42 110.346 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.5 t -60.03 -50.38 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.678 -0.639 . . . . 0.95 110.78 -178.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.86 ' HG3' HD11 ' A' ' 39' ' ' LEU . 29.5 mm100 -61.72 -49.24 77.26 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.202 -0.999 . . . . 1.84 109.923 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -45.04 -48.65 9.65 Favored Glycine 0 N--CA 1.506 3.333 0 N-CA-C 109.561 -1.415 . . . . 0.36 109.561 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -64.04 -35.99 82.52 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.889 -0.771 . . . . 1.12 110.742 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 11' ' ' VAL . 69.4 t -59.01 -40.05 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.414 -0.804 . . . . 0.46 109.809 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.705 HG13 HG13 ' A' ' 29' ' ' VAL . 59.1 t -59.98 -49.72 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 108.247 -1.019 . . . . 0.7 108.247 178.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -60.04 -45.34 93.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.696 -0.627 . . . . 3.15 110.211 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.94 -40.04 91.75 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.62 -0.675 . . . . 2.23 111.063 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 71.9 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.433 -0.792 . . . . 1.02 110.685 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.738 ' HE3' HG11 ' A' ' 29' ' ' VAL . 13.6 mmtp -63.37 -40.06 96.23 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.164 -0.68 . . . . 2.08 109.164 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.55 -26.39 68.68 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.522 -0.918 . . . . 0.81 108.522 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 76.5 mttt -86.03 8.73 19.49 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.791 -0.568 . . . . 2.11 110.629 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 48.3 mttp 59.31 20.03 8.22 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.308 -0.87 . . . . 2.28 110.545 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.58 155.9 56.97 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.59 -0.694 . . . . 0.71 110.013 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.45 160.36 50.08 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.434 1.229 . . . . 0.93 110.454 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -55.05 -26.49 37.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.498 -0.751 . . . . 2.0 110.53 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -59.95 -40.01 87.52 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.577 -0.702 . . . . 2.22 110.898 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -69.86 -43.12 72.52 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.404 -0.81 . . . . 1.46 111.023 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.738 HG11 ' HE3' ' A' ' 20' ' ' LYS . 90.4 t -68.02 -43.79 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.65 110.287 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.492 ' O ' HG12 ' A' ' 33' ' ' VAL . 85.3 m-20 -59.99 -43.52 95.11 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.494 -0.754 . . . . 1.33 111.322 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -47.66 83.96 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.378 -0.826 . . . . 0.46 110.928 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.48 -40.14 95.11 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 120.006 -0.677 . . . . 0.39 110.686 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -68.17 -39.96 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 119.487 -0.885 . . . . 0.57 108.881 179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.5 tttp -60.44 -40.95 92.97 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.198 -1.038 . . . . 2.82 108.198 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.3 -39.57 93.44 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.303 -0.999 . . . . 1.73 108.303 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.901 HD22 HD12 ' A' ' 39' ' ' LEU . 1.6 tm? -57.88 -40.01 79.21 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 116.033 -0.53 . . . . 1.53 109.851 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mp -56.77 -39.11 73.46 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.172 -0.955 . . . . 1.36 109.005 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.4 t -59.96 -39.65 86.34 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.87 -0.789 . . . . 1.31 108.87 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.901 HD12 HD22 ' A' ' 36' ' ' LEU . 82.7 mt -64.31 -39.8 94.63 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.935 -0.765 . . . . 0.72 108.935 179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -59.25 -37.37 77.44 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.805 -0.559 . . . . 2.38 109.593 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.95 -39.99 87.46 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.585 -0.697 . . . . 0.69 109.799 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.53 -41.77 92.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.298 -0.876 . . . . 1.9 109.614 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -60.01 -47.24 86.63 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.653 -0.655 . . . . 2.03 111.782 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.499 ' CB ' ' HA ' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -55.67 -28.75 57.2 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.562 -0.711 . . . . 2.12 111.614 -177.037 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.468 ' N ' ' HG3' ' A' ' 44' ' ' LYS . 58.1 mm-40 -60.02 -39.93 87.58 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.256 -0.903 . . . . 2.41 110.5 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -63.31 -52.78 60.5 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.513 -0.742 . . . . 2.31 112.238 -178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 m -156.37 -70.92 0.11 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 121.011 -1.056 . . . . 2.51 112.767 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -86.63 -113.83 0.91 Allowed Glycine 0 N--CA 1.493 2.487 0 C-N-CA 119.926 -1.13 . . . . 1.86 113.2 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.499 ' HA ' ' CB ' ' A' ' 44' ' ' LYS . 32.9 mt-30 -140.98 -30.26 0.64 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.994 -0.71 . . . . 2.7 112.87 -176.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -158.02 155.74 29.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.086 -1.009 . . . . 2.37 111.425 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.445 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 51.7 p90 -65.88 150.26 48.88 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.693 -0.629 . . . . 2.77 110.454 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.6 mttt -62.56 148.42 90.67 Favored Pre-proline 0 N--CA 1.498 1.972 0 O-C-N 121.487 -0.758 . . . . 5.01 110.155 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -76.56 8.95 2.77 Favored 'Trans proline' 0 N--CA 1.487 1.091 0 O-C-N 123.326 1.172 . . . . 3.45 112.915 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.85 20.06 17.51 Favored Glycine 0 N--CA 1.499 2.9 0 O-C-N 120.781 -1.199 . . . . 3.07 112.052 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.404 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 1.3 m-20 57.58 174.77 0.04 OUTLIER Pre-proline 0 N--CA 1.505 2.276 0 O-C-N 120.83 -1.394 . . . . 4.09 110.76 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.643 ' HD3' ' HB1' ' A' ' 10' ' ' ALA . 39.6 Cg_endo -69.99 149.99 66.2 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 O-C-N 123.497 1.262 . . . . 4.1 111.033 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.469 ' HG2' HD11 ' A' ' 3' ' ' LEU . 42.9 Cg_endo . . . . . 0 N--CA 1.485 1.029 0 O-C-N 123.513 1.27 . . . . 4.82 110.482 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.643 ' OD1' HG23 ' A' ' 4' ' ' VAL . 12.9 p-10 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 121.252 0.548 . . . . 3.98 110.499 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m -60.0 -39.96 87.55 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.641 -0.662 . . . . 1.95 110.525 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.3 OUTLIER -60.46 -41.01 93.27 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.667 -0.646 . . . . 1.69 110.511 -179.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.643 HG23 ' OD1' ' A' ' 1' ' ' ASP . 84.5 t -59.93 -49.79 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.201 -0.937 . . . . 1.52 109.094 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mp -60.04 -38.12 81.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.639 -0.663 . . . . 1.92 109.927 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.482 ' CE1' ' HB2' ' A' ' 52' ' ' LYS . 17.0 t80 -59.98 -40.0 87.63 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.599 -0.688 . . . . 3.87 110.127 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 11' ' ' VAL . 73.6 m-20 -60.02 -39.64 86.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.499 -0.751 . . . . 1.35 110.23 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -59.97 -51.11 71.07 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.38 -0.825 . . . . 2.93 110.534 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.603 HG22 ' CD2' ' A' ' 51' ' ' TYR . 8.3 p -69.04 -42.5 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.452 -0.78 . . . . 1.07 109.785 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.416 ' N ' HG13 ' A' ' 9' ' ' VAL . . . -60.05 -47.61 85.15 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.543 -0.723 . . . . 0.42 111.269 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.633 ' O ' HG23 ' A' ' 15' ' ' VAL . 56.1 t -60.02 -48.13 89.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.61 -0.681 . . . . 0.95 110.732 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.24 -55.17 31.02 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.194 -0.941 . . . . 1.84 109.709 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.94 -55.02 2.92 Favored Glycine 0 N--CA 1.508 3.445 0 N-CA-C 111.095 -0.802 . . . . 0.36 111.095 -178.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -63.87 -38.46 91.16 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.75 -0.853 . . . . 1.12 111.377 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 11' ' ' VAL . 72.6 t -59.46 -40.05 80.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.459 -0.776 . . . . 0.46 109.683 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.538 HG22 ' HB3' ' A' ' 32' ' ' ALA . 54.5 t -59.96 -50.05 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.271 -0.893 . . . . 0.7 108.67 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.6 ttp85 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.604 -0.685 . . . . 3.15 109.967 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -60.11 -45.14 93.96 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.626 -0.671 . . . . 2.23 110.442 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.95 -40.09 87.8 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 121.401 0.62 . . . . 1.02 110.088 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.694 ' HD2' HG21 ' A' ' 29' ' ' VAL . 2.4 tptm -63.33 -40.15 96.53 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 109.018 -0.734 . . . . 2.08 109.018 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.44 -27.81 68.78 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.214 -1.032 . . . . 0.81 108.214 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 59.5 mtpt -86.37 9.11 18.97 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.765 -0.585 . . . . 2.11 110.904 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 56.1 mttm 59.32 22.11 10.44 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.28 -0.887 . . . . 2.28 110.9 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.27 161.09 10.6 Favored Pre-proline 0 N--CA 1.499 1.98 0 O-C-N 121.603 -0.686 . . . . 0.71 110.397 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.12 158.3 52.42 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.462 1.243 . . . . 0.93 110.143 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -55.48 -28.06 52.21 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.501 -0.75 . . . . 2.0 110.448 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -59.33 -41.63 89.56 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.624 -0.672 . . . . 2.22 110.352 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -70.5 -42.78 70.89 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.489 -0.757 . . . . 1.46 110.37 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.694 HG21 ' HD2' ' A' ' 20' ' ' LYS . 65.7 t -68.86 -49.39 64.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.726 -0.609 . . . . 0.65 110.522 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.416 ' O ' HG12 ' A' ' 33' ' ' VAL . 99.6 m-20 -60.08 -43.23 95.64 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.433 -0.792 . . . . 1.33 111.491 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.19 -49.99 75.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.308 -0.87 . . . . 0.46 110.707 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.538 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -65.32 -41.57 93.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 120.188 -0.605 . . . . 0.39 110.548 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.416 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.09 -38.44 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 N-CA-C 108.262 -1.014 . . . . 0.57 108.262 179.357 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -60.82 -41.21 95.28 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.687 -0.857 . . . . 2.82 108.687 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.1 tp60 -64.69 -41.93 95.68 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.221 -1.029 . . . . 1.73 108.221 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.601 HD13 ' C ' ' A' ' 36' ' ' LEU . 3.1 tm? -60.01 -41.18 91.59 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 116.065 -0.516 . . . . 1.53 110.093 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.9 mt -59.6 -40.01 86.06 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.409 -0.807 . . . . 1.36 109.946 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 53.6 m -60.08 -39.99 88.01 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.593 -0.692 . . . . 1.31 109.255 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.1 -46.5 80.82 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.453 -0.943 . . . . 0.72 108.453 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -60.04 -40.98 91.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.926 -0.484 . . . . 2.38 110.348 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.05 -40.44 97.7 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.527 -0.733 . . . . 0.69 110.285 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -66.76 -39.98 88.07 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.52 -0.737 . . . . 1.9 110.037 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.02 -43.62 95.14 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.542 -0.724 . . . . 2.03 109.952 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -63.71 -27.6 69.32 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.668 -0.645 . . . . 2.12 111.81 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -55.04 -39.57 69.3 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.151 -0.968 . . . . 2.41 110.911 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -62.24 -58.41 7.85 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.568 -0.708 . . . . 2.31 110.276 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.475 HG23 ' HG3' ' A' ' 49' ' ' GLN . 4.4 t -161.43 29.57 0.13 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.461 -0.774 . . . . 2.51 110.377 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.46 47.64 27.37 Favored Glycine 0 N--CA 1.495 2.569 0 N-CA-C 110.526 -1.03 . . . . 1.86 110.526 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.475 ' HG3' HG23 ' A' ' 47' ' ' THR . 99.5 mt-30 -85.71 -11.43 53.71 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.356 -1.085 . . . . 2.7 111.163 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 35.97 -157.76 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.689 0 N-CA-C 112.519 0.562 . . . . 2.37 112.519 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.603 ' CD2' HG22 ' A' ' 9' ' ' VAL . 33.4 t80 -67.59 116.15 7.99 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.275 -0.891 . . . . 2.77 109.919 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.482 ' HB2' ' CE1' ' A' ' 6' ' ' TYR . 10.2 mmmt -69.95 135.77 87.46 Favored Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.482 -0.761 . . . . 5.01 109.58 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -81.34 -166.99 0.44 Allowed 'Trans proline' 0 C--N 1.318 -1.061 0 O-C-N 123.095 1.05 . . . . 3.45 111.212 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 75.63 5.54 78.83 Favored Glycine 0 N--CA 1.495 2.604 0 O-C-N 121.681 -0.637 . . . . 3.07 112.029 179.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.419 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 72.7 m-80 55.46 165.55 0.06 OUTLIER Pre-proline 0 N--CA 1.506 2.363 0 CA-C-N 118.693 1.247 . . . . 4.09 111.164 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 55' ' ' ASN . 37.9 Cg_endo -70.02 150.01 66.02 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 O-C-N 122.946 0.972 . . . . 4.1 111.182 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.32 -0.961 0 O-C-N 123.522 1.275 . . . . 4.82 110.501 179.908 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.564 ' O ' HG22 ' A' ' 4' ' ' VAL . 94.5 m-20 . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 121.209 0.528 . . . . 3.98 110.69 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -69.22 -10.39 57.54 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.597 -0.69 . . . . 1.95 111.108 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.609 HD13 ' O ' ' A' ' 3' ' ' LEU . 0.5 OUTLIER -59.95 -42.9 95.05 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.231 -0.918 . . . . 1.69 111.197 -178.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.566 HG23 HD12 ' A' ' 5' ' ' LEU . 29.6 m -54.93 -43.42 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.212 -0.93 . . . . 1.52 110.622 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.566 HD12 HG23 ' A' ' 4' ' ' VAL . 2.3 mp -60.9 -40.1 91.81 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.453 -0.779 . . . . 1.92 109.69 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.496 ' O ' HG22 ' A' ' 9' ' ' VAL . 5.4 t80 -59.66 -39.37 84.2 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.542 0.687 . . . . 3.87 110.028 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.746 ' O ' HG23 ' A' ' 11' ' ' VAL . 24.6 m120 -59.97 -39.34 85.32 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.756 . . . . 1.35 110.048 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.4 mmm-85 -60.01 -49.91 75.8 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.768 . . . . 2.93 110.519 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.763 HG12 ' HB3' ' A' ' 39' ' ' LEU . 32.9 m -67.19 -40.07 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 C-N-CA 119.235 -0.986 . . . . 1.07 108.417 179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.96 93.2 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.756 -0.59 . . . . 0.42 111.437 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.746 HG23 ' O ' ' A' ' 7' ' ' ASN . 39.6 t -59.99 -52.16 64.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.481 -0.762 . . . . 0.95 111.411 -178.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.492 ' HB3' ' HG ' ' A' ' 36' ' ' LEU . 96.5 mm-40 -60.17 -47.28 86.6 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.242 -0.911 . . . . 1.84 110.477 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.516 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -41.54 -52.59 4.47 Favored Glycine 0 N--CA 1.509 3.531 0 N-CA-C 109.936 -1.266 . . . . 0.36 109.936 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.5 m-20 -65.97 -37.04 84.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 122.122 -0.634 . . . . 1.12 111.256 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 11' ' ' VAL . 93.3 t -60.02 -40.31 82.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 O-C-N 121.315 -0.866 . . . . 0.46 109.689 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.0 t -60.04 -49.91 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 108.878 -0.786 . . . . 0.7 108.878 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.57 -43.0 97.77 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.612 -0.68 . . . . 3.15 110.784 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -61.63 -44.24 97.36 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.408 -0.807 . . . . 2.23 111.084 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 85.9 mt -60.04 -39.97 87.76 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 121.427 0.632 . . . . 1.02 110.464 -179.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -65.98 -39.99 90.83 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-O 121.253 0.549 . . . . 2.08 109.571 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.92 -27.55 66.85 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 108.918 -0.771 . . . . 0.81 108.918 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' HE2' ' HA ' ' A' ' 19' ' ' LEU . 9.1 mtmt -86.69 10.14 16.64 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 119.614 -0.835 . . . . 2.11 111.001 178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 58.85 21.99 9.7 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.228 -0.92 . . . . 2.28 110.812 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.498 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -58.68 160.33 10.63 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.516 -0.74 . . . . 0.71 109.944 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -74.38 167.77 26.37 Favored 'Trans proline' 0 C--N 1.316 -1.168 0 O-C-N 123.359 1.189 . . . . 0.93 109.838 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 27.1 mmtm -53.92 -22.65 10.6 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.544 -0.722 . . . . 2.0 110.364 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -55.74 -45.71 77.94 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.54 -0.725 . . . . 2.22 110.27 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.498 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 98.2 m-20 -72.22 -40.9 67.46 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.546 -0.721 . . . . 1.46 111.113 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 55.9 t -68.29 -47.61 77.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.488 -0.758 . . . . 0.65 110.214 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.8 m-20 -59.94 -46.43 89.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.715 . . . . 1.33 110.951 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.47 -49.96 73.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.406 -0.809 . . . . 0.46 110.649 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.58 -42.47 95.6 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 120.042 -0.663 . . . . 0.39 110.358 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -67.64 -37.84 79.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.465 -0.939 . . . . 0.57 108.465 179.445 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 37' ' ' LEU . 85.5 tttt -59.97 -37.87 80.86 Favored 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 121.902 0.858 . . . . 2.82 108.881 178.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -60.0 -41.56 92.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.936 -0.477 . . . . 1.73 109.761 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.516 HD11 ' HA2' ' A' ' 13' ' ' GLY . 22.6 mt -59.15 -39.97 84.09 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.837 -0.539 . . . . 1.53 110.771 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 34' ' ' LYS . 84.4 mt -58.32 -40.58 82.45 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.519 -0.738 . . . . 1.36 110.032 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.5 m -62.35 -39.99 94.94 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 119.744 -0.783 . . . . 1.31 109.644 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HG12 ' A' ' 9' ' ' VAL . 25.6 mt -66.9 -51.49 54.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.644 . . . . 0.72 109.379 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -60.72 -39.96 90.54 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.753 -0.592 . . . . 2.38 109.735 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.1 -42.51 94.82 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.885 -0.509 . . . . 0.69 111.042 -179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -70.03 -43.15 71.88 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.324 -0.86 . . . . 1.9 110.749 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.429 ' CD1' ' CB ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -62.02 -49.02 77.69 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.476 -0.765 . . . . 2.03 112.352 -179.335 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -59.7 -23.16 62.9 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.225 -0.922 . . . . 2.12 111.429 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -60.04 -39.99 87.84 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.418 -0.801 . . . . 2.41 110.807 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -67.99 -60.06 2.79 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.374 -0.93 . . . . 2.31 110.561 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.545 HG22 ' O ' ' A' ' 47' ' ' THR . 32.7 m -160.18 45.29 0.22 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.148 -0.97 . . . . 2.51 111.868 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.38 42.08 96.17 Favored Glycine 0 N--CA 1.5 2.911 0 N-CA-C 109.073 -1.611 . . . . 1.86 109.073 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.429 ' CB ' ' CD1' ' A' ' 43' ' ' TYR . 93.8 mt-30 -96.76 28.35 3.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.703 -0.88 . . . . 2.7 110.939 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -52.41 178.44 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.712 -0.617 . . . . 2.37 110.849 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -55.13 102.94 0.08 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.541 -0.724 . . . . 2.77 111.519 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 19.3 mtmt -70.38 156.04 92.5 Favored Pre-proline 0 N--CA 1.494 1.726 0 N-CA-C 109.158 -0.682 . . . . 5.01 109.158 178.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -76.82 -175.39 2.6 Favored 'Trans proline' 0 C--N 1.314 -1.246 0 O-C-N 123.24 1.126 . . . . 3.45 111.446 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 73.95 4.43 67.16 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 111.39 -0.684 . . . . 3.07 111.39 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.0 174.31 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.19 0 O-C-N 120.963 -1.316 . . . . 4.09 110.808 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.0 150.02 66.18 Favored 'Trans proline' 0 N--CA 1.487 1.106 0 O-C-N 123.387 1.204 . . . . 4.1 110.326 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 C--N 1.316 -1.141 0 O-C-N 123.431 1.227 . . . . 4.82 110.472 -179.747 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 121.34 0.59 . . . . 3.98 110.236 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 5' ' ' LEU . 50.6 m -61.31 -40.0 92.58 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.614 -0.679 . . . . 1.95 110.543 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.13 -41.02 97.85 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.477 -0.764 . . . . 1.69 109.872 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 54.4 t -59.82 -41.06 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.88 -0.513 . . . . 1.52 110.421 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 2' ' ' SER . 57.6 mt -60.01 -43.5 95.19 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.251 -0.906 . . . . 1.92 109.843 -179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -60.02 -39.11 84.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.611 -0.68 . . . . 3.87 109.75 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.734 ' O ' HG13 ' A' ' 11' ' ' VAL . 30.8 m120 -60.99 -40.64 94.27 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.45 -0.781 . . . . 1.35 110.719 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.7 -50.39 73.67 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.298 -0.876 . . . . 2.93 110.956 -179.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.763 HG12 ' HB3' ' A' ' 39' ' ' LEU . 17.5 m -70.14 -40.57 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 1.07 108.472 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.438 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -60.84 -50.54 73.01 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 112.89 0.7 . . . . 0.42 112.89 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.734 HG13 ' O ' ' A' ' 7' ' ' ASN . 32.8 m -60.2 -45.2 96.34 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 O-C-N 121.169 -0.957 . . . . 0.95 111.827 -177.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.53 ' HG3' HD11 ' A' ' 39' ' ' LEU . 29.5 mm100 -60.15 -50.39 73.88 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.049 -1.032 . . . . 1.84 110.372 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.606 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -45.79 -41.69 10.34 Favored Glycine 0 N--CA 1.507 3.372 0 N-CA-C 109.302 -1.519 . . . . 0.36 109.302 -178.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -66.16 -37.44 85.66 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 122.097 -0.649 . . . . 1.12 110.908 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.1 t -60.01 -40.87 84.36 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.53 -0.731 . . . . 0.46 110.012 -178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.453 HG22 ' CB ' ' A' ' 32' ' ' ALA . 61.5 t -60.69 -46.36 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.281 -0.887 . . . . 0.7 109.045 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -59.95 -40.06 87.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.571 -0.705 . . . . 3.15 110.654 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -59.99 -42.82 95.06 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.546 -0.721 . . . . 2.23 110.059 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.03 -40.03 87.92 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.752 -0.592 . . . . 1.02 110.577 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.582 ' HE2' HG11 ' A' ' 29' ' ' VAL . 46.8 mmtt -60.63 -44.19 96.65 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.33 -0.856 . . . . 2.08 109.093 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.26 68.55 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.312 -0.996 . . . . 0.81 108.312 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -85.48 8.21 19.95 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.761 -0.587 . . . . 2.11 110.764 179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt 58.46 21.61 8.67 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.242 -0.911 . . . . 2.28 110.755 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.61 148.68 80.91 Favored Pre-proline 0 N--CA 1.496 1.835 0 O-C-N 121.633 -0.667 . . . . 0.71 110.183 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -70.36 168.2 23.03 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 O-C-N 123.418 1.22 . . . . 0.93 110.898 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 15.3 mmmt -55.92 -30.74 62.1 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.811 -0.555 . . . . 2.0 110.84 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -59.09 -40.02 83.98 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.498 -0.751 . . . . 2.22 110.532 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -71.48 -44.07 65.43 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.433 -0.792 . . . . 1.46 110.478 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.582 HG11 ' HE2' ' A' ' 20' ' ' LYS . 94.2 t -69.08 -40.58 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.69 -0.631 . . . . 0.65 110.328 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.454 ' O ' HG12 ' A' ' 33' ' ' VAL . 87.3 m-20 -59.27 -47.84 83.86 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.334 -0.853 . . . . 1.33 111.084 -179.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.71 -49.67 75.53 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.114 -0.991 . . . . 0.46 110.651 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.453 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -66.21 -40.14 90.13 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.691 -0.63 . . . . 0.39 110.879 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.454 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.19 -38.37 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 N-CA-C 108.516 -0.92 . . . . 0.57 108.516 179.534 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 30' ' ' ASP . 64.0 mmtt -60.49 -40.0 89.74 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.527 -0.733 . . . . 2.82 109.197 177.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -61.23 -53.07 61.51 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.704 -0.623 . . . . 1.73 109.666 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.606 HD22 ' HA2' ' A' ' 13' ' ' GLY . 0.1 OUTLIER -60.16 -40.09 88.67 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.657 -0.652 . . . . 1.53 109.644 179.223 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 59.8 mt -60.06 -39.97 87.84 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.391 -0.818 . . . . 1.36 109.583 179.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 64.1 m -59.99 -39.47 85.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.625 -0.672 . . . . 1.31 109.391 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.763 ' HB3' HG12 ' A' ' 9' ' ' VAL . 93.6 mt -59.96 -55.21 36.86 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.618 -0.676 . . . . 0.72 110.581 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.7 pttp -65.77 -29.96 70.54 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.175 -0.953 . . . . 2.38 109.428 178.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.59 92.52 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 120.295 -0.562 . . . . 0.69 109.645 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -63.83 -44.64 92.63 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.233 -1.025 . . . . 1.9 108.233 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -60.42 -41.65 94.4 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.623 0.725 . . . . 2.03 109.836 178.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.98 -39.75 86.79 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.829 -0.545 . . . . 2.12 111.237 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -55.68 -40.01 71.73 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.347 -0.846 . . . . 2.41 111.187 -178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -63.71 -85.01 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.234 -0.916 . . . . 2.31 110.623 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.4 t -159.97 51.75 0.33 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.014 -1.054 . . . . 2.51 111.705 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.28 41.22 69.11 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.616 -0.994 . . . . 1.86 110.616 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -95.56 23.18 6.27 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.47 -1.017 . . . . 2.7 111.048 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -59.9 141.18 55.94 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 121.592 0.711 . . . . 2.37 110.236 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.49 ' CD2' HG21 ' A' ' 9' ' ' VAL . 55.6 p90 -56.29 149.11 17.05 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.502 0.668 . . . . 2.77 111.452 -178.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.6 mttm -68.11 158.79 82.97 Favored Pre-proline 0 N--CA 1.496 1.875 0 O-C-N 121.757 -0.59 . . . . 5.01 110.481 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -67.47 -17.63 48.95 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.327 1.172 . . . . 3.45 112.139 -178.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -85.0 13.37 54.64 Favored Glycine 0 N--CA 1.497 2.754 0 C-N-CA 119.603 -1.284 . . . . 3.07 111.93 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.433 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 3.1 m-20 55.63 178.69 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.405 0 O-C-N 120.749 -1.442 . . . . 4.09 109.879 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' A' ' 55' ' ' ASN . 37.3 Cg_endo -69.94 149.98 66.49 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 O-C-N 123.036 1.019 . . . . 4.1 110.295 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 C--N 1.318 -1.032 0 O-C-N 123.487 1.256 . . . . 4.82 110.649 -179.386 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.434 ' O ' HG12 ' A' ' 4' ' ' VAL . 49.8 t0 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.055 0.455 . . . . 3.98 110.326 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -69.9 -12.87 61.94 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.588 -0.695 . . . . 1.95 111.039 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.579 HD11 ' HG2' ' A' ' 57' ' ' PRO . 7.3 tp -60.63 -39.66 89.06 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.205 -0.934 . . . . 1.69 110.556 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.461 HG13 ' N ' ' A' ' 5' ' ' LEU . 7.8 p -55.27 -43.48 71.15 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 O-C-N 121.417 -0.802 . . . . 1.52 110.48 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.461 ' N ' HG13 ' A' ' 4' ' ' VAL . 81.1 mt -60.2 -40.0 88.56 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.637 -0.664 . . . . 1.92 109.428 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.424 ' CD1' ' HA ' ' A' ' 56' ' ' PRO . 0.3 OUTLIER -57.03 -47.58 80.57 Favored 'General case' 0 N--CA 1.498 1.952 0 CA-C-O 121.488 0.661 . . . . 3.87 109.599 179.346 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.572 ' O ' HG13 ' A' ' 11' ' ' VAL . 78.3 m-20 -62.43 -40.07 95.36 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.622 -0.674 . . . . 1.35 110.799 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.74 ' HG2' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -59.97 -49.89 75.88 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.408 -0.808 . . . . 2.93 110.647 -179.408 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.79 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.03 -40.0 80.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 1.07 109.23 179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.733 ' HB1' ' HD3' ' A' ' 56' ' ' PRO . . . -59.97 -49.74 76.48 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 112.79 0.663 . . . . 0.42 112.79 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.825 ' O ' HG23 ' A' ' 15' ' ' VAL . 34.2 m -59.88 -45.38 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.172 -0.955 . . . . 0.95 111.037 -177.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.486 ' HG3' HD11 ' A' ' 39' ' ' LEU . 27.2 mm100 -60.93 -49.46 77.37 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.106 -0.996 . . . . 1.84 109.673 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -39.53 -58.85 2.04 Favored Glycine 0 N--CA 1.509 3.555 0 N-CA-C 110.408 -1.077 . . . . 0.36 110.408 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -63.64 -36.29 83.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.835 -0.803 . . . . 1.12 111.028 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.825 HG23 ' O ' ' A' ' 11' ' ' VAL . 90.1 t -60.01 -40.48 83.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.95 0 O-C-N 121.332 -0.855 . . . . 0.46 109.579 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 32' ' ' ALA . 66.5 t -60.2 -50.0 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.394 -0.816 . . . . 0.7 109.235 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 49.6 ttt180 -62.56 -42.95 99.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.65 -0.657 . . . . 3.15 111.244 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.96 -44.44 94.43 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.557 -0.714 . . . . 2.23 110.722 -178.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.4 mt -59.98 -40.03 87.71 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.822 -0.549 . . . . 1.02 110.904 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.667 ' HD3' HG21 ' A' ' 29' ' ' VAL . 12.2 tptt -65.99 -40.05 90.83 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.646 -0.659 . . . . 2.08 109.383 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.58 -26.99 67.36 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 108.841 -0.8 . . . . 0.81 108.841 178.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 98.3 mttt -86.17 9.13 18.39 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 120.058 -0.657 . . . . 2.11 110.509 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 84.6 mttt 58.97 19.94 7.68 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.377 -0.827 . . . . 2.28 110.968 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.596 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -58.94 167.58 1.88 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.57 -0.706 . . . . 0.71 109.734 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.489 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 51.4 Cg_endo -73.61 163.99 36.03 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 O-C-N 123.355 1.187 . . . . 0.93 110.107 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.1 mttp -54.59 -23.55 17.38 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.473 -0.767 . . . . 2.0 109.594 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -56.71 -40.57 75.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.704 -0.623 . . . . 2.22 110.383 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.596 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 86.6 m-20 -73.22 -42.27 62.82 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.545 -0.722 . . . . 1.46 111.023 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.667 HG21 ' HD3' ' A' ' 20' ' ' LYS . 62.5 t -69.94 -54.04 20.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 121.538 -0.726 . . . . 0.65 110.963 -179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -60.21 -41.02 92.13 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.43 -0.794 . . . . 1.33 112.101 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.79 -49.95 75.41 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.241 -0.912 . . . . 0.46 110.9 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.569 ' HB3' HG22 ' A' ' 16' ' ' VAL . . . -66.43 -41.41 89.23 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 119.938 -0.705 . . . . 0.39 110.192 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.403 ' HA ' ' HB3' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -66.63 -39.03 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.044 -1.095 . . . . 0.57 108.044 178.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 39.6 tttm -60.26 -43.74 95.91 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.179 -1.045 . . . . 2.82 108.179 177.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -65.81 -45.81 80.96 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.562 -0.903 . . . . 1.73 108.562 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.403 ' HB3' ' HA ' ' A' ' 33' ' ' VAL . 7.9 tp -59.69 -39.95 86.28 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 109.749 -0.463 . . . . 1.53 109.749 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -58.9 -39.99 83.13 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.369 -0.832 . . . . 1.36 109.512 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.0 t -61.53 -41.53 97.47 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 1.31 109.137 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.79 ' HB3' HG12 ' A' ' 9' ' ' VAL . 71.6 mt -62.57 -49.93 73.33 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.818 -0.808 . . . . 0.72 108.818 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -60.06 -40.02 88.03 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.56 0.695 . . . . 2.38 109.231 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.7 -44.27 96.78 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.951 -0.468 . . . . 0.69 110.649 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -60.01 -47.17 86.95 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.248 -0.907 . . . . 1.9 109.594 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.97 -42.74 94.79 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.918 0.866 . . . . 2.03 109.466 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -60.62 -40.03 90.4 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.942 -0.572 . . . . 2.12 112.137 -179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.44 -39.95 85.22 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.288 -0.882 . . . . 2.41 111.595 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -61.53 -51.26 69.32 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.291 -0.881 . . . . 2.31 111.462 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 47' ' ' THR . 82.4 m -157.91 16.13 0.23 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.27 -0.894 . . . . 2.51 112.093 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.03 37.74 73.67 Favored Glycine 0 N--CA 1.496 2.694 0 N-CA-C 110.074 -1.21 . . . . 1.86 110.074 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.47 ' O ' ' O ' ' A' ' 50' ' ' GLU . 97.9 mt-30 -84.73 -24.06 29.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.487 -1.008 . . . . 2.7 110.714 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.47 ' O ' ' O ' ' A' ' 49' ' ' GLN . 13.3 pt-20 40.91 175.18 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.628 0 CA-C-O 122.57 1.176 . . . . 2.37 113.924 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.425 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.6 t80 -69.45 124.45 23.91 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.149 -0.969 . . . . 2.77 110.982 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -70.84 145.85 92.49 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.527 -0.733 . . . . 5.01 109.111 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -75.82 -6.91 18.0 Favored 'Trans proline' 0 C--N 1.315 -1.224 0 O-C-N 123.257 1.135 . . . . 3.45 112.996 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.14 32.54 4.06 Favored Glycine 0 N--CA 1.502 3.078 0 C-N-CA 119.559 -1.305 . . . . 3.07 112.767 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.426 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.3 OUTLIER 54.46 179.82 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.529 0 CA-C-N 119.176 1.488 . . . . 4.09 110.288 179.219 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.733 ' HD3' ' HB1' ' A' ' 10' ' ' ALA . 37.8 Cg_endo -69.93 149.98 66.53 Favored 'Trans proline' 0 N--CA 1.488 1.17 0 O-C-N 123.151 1.079 . . . . 4.1 111.063 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.579 ' HG2' HD11 ' A' ' 3' ' ' LEU . 48.1 Cg_endo . . . . . 0 C--N 1.321 -0.901 0 O-C-N 123.597 1.314 . . . . 4.82 110.684 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.675 ' O ' HG22 ' A' ' 4' ' ' VAL . 6.1 t70 . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 120.957 0.408 . . . . 3.98 110.054 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.2 m -68.33 -12.59 61.31 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.481 -0.762 . . . . 1.95 110.996 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tt -62.08 -35.78 79.69 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.121 -0.987 . . . . 1.69 110.736 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 1' ' ' ASP . 35.7 m -55.62 -42.07 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.349 -0.845 . . . . 1.52 110.385 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.468 ' N ' HG23 ' A' ' 4' ' ' VAL . 68.6 mt -60.47 -41.43 94.18 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.499 -0.751 . . . . 1.92 109.603 178.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -42.8 78.51 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.8 -0.563 . . . . 3.87 110.129 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.612 ' O ' HG23 ' A' ' 11' ' ' VAL . 28.9 m120 -59.9 -40.09 87.61 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.574 -0.704 . . . . 1.35 111.509 -179.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -60.08 -56.32 23.05 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.178 -0.951 . . . . 2.93 110.378 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.607 HG21 ' CD1' ' A' ' 51' ' ' TYR . 8.6 p -69.32 -38.03 76.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.401 -0.812 . . . . 1.07 110.128 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.549 ' HB1' ' HB2' ' A' ' 55' ' ' ASN . . . -59.98 -46.43 89.49 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.57 -0.706 . . . . 0.42 111.557 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 7' ' ' ASN . 63.6 t -59.98 -47.96 89.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.548 -0.72 . . . . 0.95 110.383 -178.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.487 ' O ' HG12 ' A' ' 15' ' ' VAL . 6.7 tp-100 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.359 -0.838 . . . . 1.84 109.97 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -42.6 -48.53 5.93 Favored Glycine 0 N--CA 1.508 3.48 0 N-CA-C 110.181 -1.168 . . . . 0.36 110.181 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -62.89 -37.36 86.63 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.999 -0.707 . . . . 1.12 111.464 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.487 HG12 ' O ' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -59.21 -39.24 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.156 -0.965 . . . . 0.46 109.702 -179.023 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.48 HG22 ' CB ' ' A' ' 32' ' ' ALA . 54.5 t -59.97 -44.8 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 N-CA-C 108.924 -0.769 . . . . 0.7 108.924 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -59.99 -41.6 92.38 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.598 -0.689 . . . . 3.15 109.868 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.04 -40.1 95.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.666 -0.646 . . . . 2.23 111.18 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.4 mt -61.08 -40.0 92.06 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.411 -0.806 . . . . 1.02 110.86 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.504 ' CD ' HG21 ' A' ' 29' ' ' VAL . 12.4 tptm -65.69 -42.31 91.35 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.504 -0.747 . . . . 2.08 109.028 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.24 -23.82 64.38 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.767 -0.827 . . . . 0.81 108.767 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 mtpp -85.95 8.62 19.7 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.683 -0.636 . . . . 2.11 110.721 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp 59.3 20.09 8.27 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.272 -0.892 . . . . 2.28 111.144 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.99 161.76 8.38 Favored Pre-proline 0 N--CA 1.498 1.945 0 O-C-N 121.506 -0.746 . . . . 0.71 110.137 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.39 165.26 32.26 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.485 1.255 . . . . 0.93 110.912 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -57.0 -31.7 65.36 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.672 -0.642 . . . . 2.0 110.673 -179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -58.64 -40.02 82.23 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.571 -0.705 . . . . 2.22 110.507 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -70.13 -41.45 73.89 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.637 -0.664 . . . . 1.46 110.77 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.504 HG21 ' CD ' ' A' ' 20' ' ' LYS . 99.8 t -66.93 -51.27 56.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.566 -0.709 . . . . 0.65 109.751 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 81.3 m-20 -60.02 -45.6 92.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.758 -0.589 . . . . 1.33 110.758 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.46 75.39 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.311 -0.868 . . . . 0.46 110.36 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.48 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -63.34 -43.5 97.56 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.139 -0.624 . . . . 0.39 110.628 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.656 ' HA ' HD23 ' A' ' 36' ' ' LEU . 0.5 OUTLIER -65.63 -37.34 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 119.456 -0.898 . . . . 0.57 108.839 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 tppt? -59.97 -39.2 84.83 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 121.778 0.799 . . . . 2.82 109.207 178.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -60.0 -45.67 91.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.924 -0.485 . . . . 1.73 110.703 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.656 HD23 ' HA ' ' A' ' 33' ' ' VAL . 0.5 OUTLIER -60.06 -35.29 74.83 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.298 -0.876 . . . . 1.53 110.344 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.515 HD12 ' HG ' ' A' ' 36' ' ' LEU . 2.2 mp -58.66 -39.77 81.59 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.234 -0.916 . . . . 1.36 109.643 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.451 ' O ' ' HB3' ' A' ' 41' ' ' ALA . 24.6 p -60.01 -40.01 87.81 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 109.095 -0.705 . . . . 1.31 109.095 179.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 88.5 mt -65.16 -47.66 76.27 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.986 -0.746 . . . . 0.72 108.986 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -61.39 -31.57 71.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.148 -0.686 . . . . 2.38 109.148 178.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 38' ' ' SER . . . -59.84 -41.5 91.51 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.698 -0.626 . . . . 0.69 109.419 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.87 -48.64 79.6 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 119.79 -0.764 . . . . 1.9 109.208 178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.458 ' CE2' ' CB ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -61.06 -38.51 86.46 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 121.917 0.865 . . . . 2.03 108.772 178.076 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -60.55 -27.31 67.56 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 116.085 -0.507 . . . . 2.12 111.308 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -55.02 -39.85 69.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.252 -0.905 . . . . 2.41 110.929 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -64.63 -59.85 3.8 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.549 -0.861 . . . . 2.31 110.356 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -165.55 28.89 0.05 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.296 -0.878 . . . . 2.51 111.637 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.98 73.38 0.69 Allowed Glycine 0 N--CA 1.497 2.765 0 N-CA-C 108.994 -1.643 . . . . 1.86 108.994 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 28.9 mm100 -87.02 -16.42 35.74 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.634 -0.921 . . . . 2.7 111.984 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 30.26 100.22 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.994 0 N-CA-C 113.267 0.84 . . . . 2.37 113.267 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.607 ' CD1' HG21 ' A' ' 9' ' ' VAL . 32.6 p90 -57.09 140.56 48.92 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.125 -0.984 . . . . 2.77 111.492 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.6 mttp -64.67 164.28 21.67 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.657 -0.652 . . . . 5.01 109.709 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.63 -30.01 18.87 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.397 1.209 . . . . 3.45 111.294 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -87.2 29.54 5.14 Favored Glycine 0 N--CA 1.496 2.683 0 C-N-CA 119.724 -1.226 . . . . 3.07 111.892 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.549 ' HB2' ' HB1' ' A' ' 10' ' ' ALA . 0.9 OUTLIER 52.01 -178.15 0.02 OUTLIER Pre-proline 0 N--CA 1.503 2.19 0 CA-C-N 118.786 1.293 . . . . 4.09 110.484 179.524 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.406 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 37.8 Cg_endo -69.99 149.97 66.18 Favored 'Trans proline' 0 N--CA 1.49 1.302 0 O-C-N 122.883 0.938 . . . . 4.1 111.44 -179.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo . . . . . 0 C--N 1.318 -1.061 0 O-C-N 123.308 1.162 . . . . 4.82 110.603 -179.212 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.194 0.521 . . . . 3.98 110.276 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.5 p -68.5 -23.06 64.51 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.615 -0.678 . . . . 1.95 110.306 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.58 -42.87 99.48 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.254 -0.904 . . . . 1.69 109.363 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.5 t -55.42 -44.07 74.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 N-CA-C 109.348 -0.612 . . . . 1.52 109.348 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 98.1 mt -61.39 -40.5 94.56 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.782 -0.574 . . . . 1.92 110.662 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.458 ' O ' HG22 ' A' ' 9' ' ' VAL . 11.1 m-85 -59.75 -40.05 86.82 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.498 -0.751 . . . . 3.87 110.463 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.868 ' O ' HG23 ' A' ' 11' ' ' VAL . 29.6 m120 -60.16 -40.21 89.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.574 -0.704 . . . . 1.35 110.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.92 -49.76 76.41 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.485 -0.759 . . . . 2.93 111.232 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.525 ' HA ' HD13 ' A' ' 39' ' ' LEU . 26.9 m -65.21 -39.95 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 1.07 109.61 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.57 -38.34 84.27 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.465 -0.772 . . . . 0.42 110.736 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.868 HG23 ' O ' ' A' ' 7' ' ' ASN . 72.7 t -60.1 -50.13 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.642 -0.661 . . . . 0.95 110.7 -177.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.465 ' HG2' HD11 ' A' ' 39' ' ' LEU . 6.7 mp0 -61.87 -50.93 70.25 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.011 -1.056 . . . . 1.84 109.818 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -41.58 -49.93 4.84 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.974 -1.25 . . . . 0.36 109.974 -178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -64.39 -36.8 85.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 122.07 -0.665 . . . . 1.12 111.342 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 68.3 t -59.66 -41.07 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.188 -0.945 . . . . 0.46 109.726 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -59.94 -48.09 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 121.265 -0.897 . . . . 0.7 108.944 178.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -60.05 -47.6 85.17 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.656 -0.652 . . . . 3.15 110.337 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -62.47 -42.55 99.56 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.589 -0.694 . . . . 2.23 111.192 -178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.7 -40.25 96.32 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.317 -0.865 . . . . 1.02 111.039 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.502 ' HD2' HG21 ' A' ' 29' ' ' VAL . 17.0 tptm -66.33 -40.23 89.77 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.637 -0.665 . . . . 2.08 109.882 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -28.12 68.12 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.474 -0.936 . . . . 0.81 108.474 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 62.7 mtpt -84.08 8.77 14.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.854 -0.529 . . . . 2.11 111.002 178.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 95.3 mttt 57.61 27.57 14.4 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.145 -0.972 . . . . 2.28 111.094 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.419 ' HB1' ' HD2' ' A' ' 25' ' ' PRO . . . -57.18 163.43 3.19 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.739 -0.601 . . . . 0.71 110.706 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.419 ' HD2' ' HB1' ' A' ' 24' ' ' ALA . 43.7 Cg_endo -68.9 166.17 27.37 Favored 'Trans proline' 0 C--N 1.315 -1.217 0 O-C-N 123.592 1.312 . . . . 0.93 110.081 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -58.52 -34.33 70.85 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.671 -0.643 . . . . 2.0 110.811 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -56.65 -39.79 74.31 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.583 -0.698 . . . . 2.22 110.419 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.86 -46.57 57.47 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.658 -0.651 . . . . 1.46 111.326 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.502 HG21 ' HD2' ' A' ' 20' ' ' LYS . 94.3 t -69.41 -50.05 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.075 0 O-C-N 121.251 -0.906 . . . . 0.65 111.134 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' O ' HG12 ' A' ' 33' ' ' VAL . 59.3 m-20 -59.91 -49.11 78.98 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.454 -0.779 . . . . 1.33 111.277 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.0 -46.21 91.68 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.506 -0.747 . . . . 0.46 110.766 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.37 -45.31 80.5 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 119.867 -0.733 . . . . 0.39 110.159 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -64.97 -39.63 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.19 -1.041 . . . . 0.57 108.19 179.407 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.441 ' HA ' HD12 ' A' ' 37' ' ' LEU . 34.7 tttp -61.52 -41.64 97.63 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.105 -1.072 . . . . 2.82 108.105 177.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -65.84 -42.84 90.0 Favored 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.539 -0.912 . . . . 1.73 108.539 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.602 HD13 ' C ' ' A' ' 36' ' ' LEU . 3.3 tm? -60.04 -40.81 90.66 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 115.952 -0.567 . . . . 1.53 109.719 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 34' ' ' LYS . 74.4 mt -59.99 -39.71 86.66 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.611 -0.68 . . . . 1.36 109.754 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 46.6 t -59.87 -36.62 77.27 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.73 -0.607 . . . . 1.31 109.521 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 9' ' ' VAL . 82.3 mt -60.05 -51.09 71.12 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.611 -0.681 . . . . 0.72 110.117 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -60.98 -39.33 89.22 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.527 -0.733 . . . . 2.38 109.627 179.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.55 91.87 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.766 -0.584 . . . . 0.69 110.487 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -60.79 -49.45 77.46 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.306 -0.871 . . . . 1.9 109.591 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -61.37 -38.26 86.36 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.688 -0.632 . . . . 2.03 110.092 178.749 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -59.89 -37.78 80.36 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.72 -0.613 . . . . 2.12 110.771 -178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -57.98 -39.46 78.23 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.423 -0.798 . . . . 2.41 111.25 -179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -61.21 -54.33 45.57 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.12 -0.988 . . . . 2.31 111.229 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 47' ' ' THR . 41.4 m -156.61 16.47 0.31 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.256 -0.902 . . . . 2.51 111.433 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.74 29.97 68.89 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.48 -1.048 . . . . 1.86 110.48 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' GLU . 91.5 mm-40 -83.95 -23.83 30.94 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.32 -1.106 . . . . 2.7 110.866 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.432 ' HA ' ' HB3' ' A' ' 43' ' ' TYR . 8.5 pt-20 40.64 -175.1 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 CA-C-O 121.805 0.812 . . . . 2.37 112.855 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.413 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.1 t80 -66.46 101.96 0.82 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.152 -0.968 . . . . 2.77 110.595 -178.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -69.98 160.04 81.9 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.507 -0.746 . . . . 5.01 109.176 178.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.4 -60.94 0.05 OUTLIER 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.178 1.094 . . . . 3.45 111.126 -179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.1 1.2 70.46 Favored Glycine 0 N--CA 1.489 2.223 0 C-N-CA 119.541 -1.314 . . . . 3.07 110.32 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.424 ' N ' ' CD ' ' A' ' 56' ' ' PRO . 7.1 m-20 48.85 49.31 7.3 Favored Pre-proline 0 N--CA 1.499 2.004 0 O-C-N 121.142 -1.21 . . . . 4.09 111.426 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' A' ' 55' ' ' ASN . 38.1 Cg_endo -69.97 150.06 66.4 Favored 'Trans proline' 0 N--CA 1.486 1.06 0 O-C-N 123.223 1.117 . . . . 4.1 110.451 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo . . . . . 0 C--N 1.317 -1.099 0 O-C-N 123.305 1.161 . . . . 4.82 110.32 179.907 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.017 0.437 . . . . 3.98 110.179 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.406 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 69.6 m -71.09 60.37 0.26 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.523 -0.736 . . . . 1.95 110.369 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.8 tp -61.6 -49.97 74.47 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.507 -0.746 . . . . 1.69 110.436 -179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -60.01 -48.94 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 1.52 110.608 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.406 ' HB2' ' HB3' ' A' ' 2' ' ' SER . 83.0 mt -60.0 -45.02 94.09 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.297 -0.877 . . . . 1.92 110.604 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.426 ' CE2' ' HB2' ' A' ' 52' ' ' LYS . 33.6 t80 -59.95 -43.5 94.97 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.419 -0.801 . . . . 3.87 110.361 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.645 ' O ' HG13 ' A' ' 11' ' ' VAL . 96.2 m-20 -60.01 -40.26 88.65 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.516 -0.74 . . . . 1.35 110.736 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.609 ' HG3' HD13 ' A' ' 39' ' ' LEU . 8.8 tpt180 -60.01 -50.02 75.37 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.522 -0.736 . . . . 2.93 110.611 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.799 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.72 -40.05 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.12 -0.987 . . . . 1.07 109.253 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.99 74.17 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 112.832 0.679 . . . . 0.42 112.832 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 7' ' ' ASN . 33.4 m -60.08 -49.01 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.229 -0.92 . . . . 0.95 111.968 -177.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.598 ' CD ' HD11 ' A' ' 39' ' ' LEU . 75.6 mt-30 -62.94 -42.61 99.86 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.872 -1.143 . . . . 1.84 109.492 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.842 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -43.63 -52.6 6.39 Favored Glycine 0 N--CA 1.507 3.412 0 N-CA-C 109.695 -1.362 . . . . 0.36 109.695 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -62.68 -34.76 77.76 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.926 -0.749 . . . . 1.12 111.221 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 11' ' ' VAL . 92.0 t -59.62 -40.04 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.29 -0.881 . . . . 0.46 109.584 -179.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.616 HG22 HG23 ' A' ' 33' ' ' VAL . 55.6 t -59.99 -49.97 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 N-CA-C 108.592 -0.892 . . . . 0.7 108.592 178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -64.85 -40.93 95.95 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-O 121.37 0.605 . . . . 3.15 110.536 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -60.0 -48.62 80.96 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.73 -0.606 . . . . 2.23 110.775 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 28' ' ' ASP . 87.1 mt -59.99 -40.51 89.44 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.643 -0.661 . . . . 1.02 110.41 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.829 ' HD3' HG21 ' A' ' 29' ' ' VAL . 35.0 tptt -69.92 -39.67 76.0 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.618 -0.882 . . . . 2.08 108.618 179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.01 -31.72 70.2 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.0 -0.741 . . . . 0.81 109.0 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.548 ' HD3' HD23 ' A' ' 19' ' ' LEU . 15.9 ptmt -92.23 19.4 7.03 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 119.529 -0.869 . . . . 2.11 110.488 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.7 mttm 59.6 20.26 8.83 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.451 -0.78 . . . . 2.28 111.678 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.4 158.7 13.82 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.413 -0.805 . . . . 0.71 109.712 179.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -73.25 167.23 27.85 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.322 1.169 . . . . 0.93 110.153 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -54.96 -24.56 24.52 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.522 -0.736 . . . . 2.0 109.566 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -57.02 -41.86 79.33 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.728 -0.608 . . . . 2.22 110.209 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.585 ' HB3' HD22 ' A' ' 19' ' ' LEU . 69.2 m-20 -75.44 -48.44 22.76 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.685 -0.634 . . . . 1.46 111.32 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.829 HG21 ' HD3' ' A' ' 20' ' ' LYS . 79.5 t -63.35 -49.54 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 O-C-N 121.535 -0.728 . . . . 0.65 109.786 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -59.95 -40.21 88.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.58 -0.7 . . . . 1.33 110.883 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.78 -51.64 68.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.301 -0.874 . . . . 0.46 110.538 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.14 90.18 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.629 -0.67 . . . . 0.39 109.296 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.616 HG23 HG22 ' A' ' 16' ' ' VAL . 9.1 t -64.59 -45.67 94.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 108.455 -0.943 . . . . 0.57 108.455 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -60.01 -40.95 91.02 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.261 -0.899 . . . . 2.82 108.822 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -65.11 -49.4 70.11 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 108.466 -0.939 . . . . 1.73 108.466 178.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.842 HD22 ' HA2' ' A' ' 13' ' ' GLY . 6.7 tp -60.0 -39.54 86.12 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 115.821 -0.627 . . . . 1.53 109.689 179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 14.0 mt -58.22 -38.66 77.26 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.419 -0.8 . . . . 1.36 109.608 179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 24.1 t -60.5 -40.7 92.32 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.607 -0.683 . . . . 1.31 109.475 178.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.799 ' HB3' HG12 ' A' ' 9' ' ' VAL . 46.4 mt -66.8 -50.95 60.98 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 109.008 -0.738 . . . . 0.72 109.008 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -59.99 -39.89 87.32 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.524 0.678 . . . . 2.38 109.274 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.81 80.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.907 -0.496 . . . . 0.69 110.512 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -60.04 -49.95 75.64 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.289 -0.882 . . . . 1.9 110.236 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -61.37 -39.96 92.55 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.573 -0.705 . . . . 2.03 110.001 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -60.0 -39.35 85.47 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.758 -0.589 . . . . 2.12 110.484 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -58.79 -37.63 76.77 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.549 -0.72 . . . . 2.41 111.12 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -61.26 -54.48 43.49 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.195 -0.941 . . . . 2.31 111.055 -179.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.16 18.21 0.36 Allowed 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.113 -0.992 . . . . 2.51 111.659 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.97 33.58 70.28 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 110.466 -1.053 . . . . 1.86 110.466 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -86.72 -13.0 46.62 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.33 -1.1 . . . . 2.7 111.628 -179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 35.92 -156.03 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 N-CA-C 112.807 0.669 . . . . 2.37 112.807 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -62.88 119.54 9.58 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.17 -0.956 . . . . 2.77 110.552 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 6' ' ' TYR . 3.8 mttm -70.13 137.11 86.91 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.665 -0.647 . . . . 5.01 109.485 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -85.06 -170.79 0.82 Allowed 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.178 1.094 . . . . 3.45 110.798 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 71.61 21.23 78.82 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.767 -0.73 . . . . 3.07 111.287 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.42 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER 55.98 177.8 0.03 OUTLIER Pre-proline 0 N--CA 1.505 2.323 0 O-C-N 121.067 -1.255 . . . . 4.09 110.419 179.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 38.4 Cg_endo -69.99 150.01 66.23 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.313 1.165 . . . . 4.1 109.977 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo . . . . . 0 C--N 1.317 -1.115 0 O-C-N 123.392 1.207 . . . . 4.82 110.746 -178.535 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.42 ' O ' HG12 ' A' ' 4' ' ' VAL . 36.8 p-10 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.944 0.402 . . . . 3.98 110.346 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -66.35 -20.62 66.13 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.509 -0.745 . . . . 1.95 110.489 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.4 ' C ' HD23 ' A' ' 3' ' ' LEU . 7.9 tt -59.95 -41.78 92.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.367 -0.833 . . . . 1.69 110.729 -178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.479 HG13 HD22 ' A' ' 5' ' ' LEU . 2.9 p -56.23 -40.88 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 O-C-N 121.272 -0.892 . . . . 1.52 110.461 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.479 HD22 HG13 ' A' ' 4' ' ' VAL . 3.5 mm? -59.79 -40.63 88.99 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.558 -0.714 . . . . 1.92 109.633 179.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.428 ' O ' HG22 ' A' ' 9' ' ' VAL . 10.3 m-85 -59.94 -40.12 87.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.611 -0.681 . . . . 3.87 110.016 178.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.832 ' O ' HG23 ' A' ' 11' ' ' VAL . 97.6 m-20 -61.47 -41.47 97.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.618 -0.676 . . . . 1.35 110.704 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttt85 -59.95 -49.73 76.55 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.541 -0.725 . . . . 2.93 111.101 -178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.911 ' HA ' HD13 ' A' ' 39' ' ' LEU . 33.1 m -66.72 -39.83 84.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.437 -0.789 . . . . 1.07 108.93 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.404 ' CB ' ' HD3' ' A' ' 56' ' ' PRO . . . -60.84 -38.57 85.95 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.797 -0.565 . . . . 0.42 110.97 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 7' ' ' ASN . 60.1 t -60.02 -49.95 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.455 -0.778 . . . . 0.95 109.985 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.843 ' HG3' HD11 ' A' ' 39' ' ' LEU . 30.1 mm100 -60.22 -51.91 67.54 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.078 -1.014 . . . . 1.84 109.283 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -40.01 -58.26 2.34 Favored Glycine 0 N--CA 1.506 3.331 0 N-CA-C 110.68 -0.968 . . . . 0.36 110.68 -178.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -61.66 -38.52 88.02 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.912 -0.758 . . . . 1.12 111.088 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 11' ' ' VAL . 85.2 t -59.75 -39.96 81.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.313 -0.867 . . . . 0.46 109.683 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.552 HG22 ' CB ' ' A' ' 32' ' ' ALA . 60.1 t -60.04 -49.76 82.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.938 0 N-CA-C 108.864 -0.791 . . . . 0.7 108.864 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -59.98 -43.48 95.1 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.72 -0.612 . . . . 3.15 110.103 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.58 -41.55 97.57 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 2.23 111.341 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 86.7 mt -60.35 -42.92 96.76 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.24 -0.913 . . . . 1.02 109.9 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.57 ' CD ' HG21 ' A' ' 29' ' ' VAL . 20.0 tptp -65.75 -40.0 91.67 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.794 -0.817 . . . . 2.08 108.794 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -26.69 66.72 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.725 -0.842 . . . . 0.81 108.725 178.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -86.97 10.28 16.85 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.113 -0.635 . . . . 2.11 110.793 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 94.4 mttt 57.35 21.38 6.74 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.294 -0.879 . . . . 2.28 111.091 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.418 ' HB1' ' OD2' ' A' ' 28' ' ' ASP . . . -60.87 162.47 12.22 Favored Pre-proline 0 N--CA 1.495 1.822 0 O-C-N 121.615 -0.678 . . . . 0.71 109.406 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.46 162.69 39.64 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.211 1.111 . . . . 0.93 111.047 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -54.48 -24.45 20.42 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.735 -0.603 . . . . 2.0 110.197 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -59.53 -40.94 88.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.643 -0.661 . . . . 2.22 110.059 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' OD2' ' HB1' ' A' ' 24' ' ' ALA . 70.0 m-20 -72.61 -45.61 58.24 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.482 -0.761 . . . . 1.46 110.843 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.57 HG21 ' CD ' ' A' ' 20' ' ' LYS . 87.1 t -67.02 -50.77 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.553 -0.717 . . . . 0.65 110.305 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.41 ' O ' HG12 ' A' ' 33' ' ' VAL . 86.3 m-20 -60.13 -43.62 95.54 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.573 -0.705 . . . . 1.33 111.121 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.22 -50.01 73.47 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.381 -0.824 . . . . 0.46 110.655 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.552 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -65.38 -42.53 92.59 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 120.261 -0.576 . . . . 0.39 110.492 -179.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.67 -36.57 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.084 -1.08 . . . . 0.57 108.084 179.214 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -60.06 -44.13 94.93 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 107.98 -1.118 . . . . 2.82 107.98 177.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -62.44 -40.03 95.29 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-O 121.85 0.833 . . . . 1.73 108.852 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.882 HD22 HD12 ' A' ' 39' ' ' LEU . 2.8 tm? -59.71 -41.5 90.96 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.4 -0.593 . . . . 1.53 109.4 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.4 mt -60.02 -40.0 87.76 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.575 -0.703 . . . . 1.36 110.39 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.7 p -62.12 -27.92 69.27 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.355 -0.841 . . . . 1.31 109.495 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.911 HD13 ' HA ' ' A' ' 9' ' ' VAL . 83.1 mt -66.9 -58.57 4.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.265 -0.897 . . . . 0.72 109.131 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.412 ' HG3' ' N ' ' A' ' 41' ' ' ALA . 1.3 ptpm? -61.77 -35.53 78.41 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-O 121.762 0.791 . . . . 2.38 109.072 178.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.412 ' N ' ' HG3' ' A' ' 40' ' ' LYS . . . -59.98 -50.05 75.26 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 116.106 -0.497 . . . . 0.69 109.948 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.34 -40.06 93.16 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.508 -0.745 . . . . 1.9 109.759 179.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.46 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -58.98 -39.59 82.22 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.682 -0.636 . . . . 2.03 109.989 179.582 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.5 mmmt -59.94 -40.04 87.57 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.604 -0.685 . . . . 2.12 111.046 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.9 -39.25 80.92 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.397 -0.814 . . . . 2.41 111.238 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.673 ' O ' HG23 ' A' ' 47' ' ' THR . 58.4 mttm -64.94 -59.95 3.6 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.28 -0.968 . . . . 2.31 110.767 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.673 HG23 ' O ' ' A' ' 46' ' ' LYS . 1.0 OUTLIER -159.46 12.52 0.14 Allowed 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.254 -0.904 . . . . 2.51 112.741 -179.771 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.84 55.23 20.75 Favored Glycine 0 N--CA 1.498 2.821 0 N-CA-C 109.169 -1.573 . . . . 1.86 109.169 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.46 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 97.1 mt-30 -83.22 -20.49 34.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.579 -0.954 . . . . 2.7 111.61 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 30.28 85.8 0.01 OUTLIER 'General case' 0 N--CA 1.519 2.986 0 N-CA-C 112.892 0.701 . . . . 2.37 112.892 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.1 p90 -56.09 147.73 19.51 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.449 -0.782 . . . . 2.77 111.252 -178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.4 mttt -67.08 156.27 88.26 Favored Pre-proline 0 N--CA 1.5 2.063 0 O-C-N 121.587 -0.696 . . . . 5.01 110.572 -179.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.25 -13.62 23.19 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.352 1.185 . . . . 3.45 112.066 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.97 44.95 3.4 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 119.611 -1.28 . . . . 3.07 111.86 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.433 ' CB ' ' HD2' ' A' ' 56' ' ' PRO . 0.4 OUTLIER 53.34 -178.81 0.02 OUTLIER Pre-proline 0 N--CA 1.506 2.349 0 O-C-N 120.946 -1.326 . . . . 4.09 110.328 179.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.433 ' HD2' ' CB ' ' A' ' 55' ' ' ASN . 37.2 Cg_endo -70.0 150.03 66.18 Favored 'Trans proline' 0 N--CA 1.487 1.121 0 O-C-N 123.106 1.056 . . . . 4.1 110.373 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo . . . . . 0 C--N 1.319 -1.004 0 O-C-N 123.388 1.204 . . . . 4.82 110.695 -178.841 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 121.069 0.461 . . . . 3.98 110.514 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.4 m -62.11 -40.01 94.45 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.617 -0.677 . . . . 1.95 110.736 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.7 tp -60.75 -45.83 92.79 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.451 -0.78 . . . . 1.69 110.114 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 90.5 t -59.22 -40.11 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.836 -0.54 . . . . 1.52 110.425 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.7 mt -60.04 -48.8 80.2 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.417 -0.802 . . . . 1.92 110.565 -179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.42 ' CE2' ' O ' ' A' ' 56' ' ' PRO . 13.3 m-85 -59.88 -39.76 86.38 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.519 -0.738 . . . . 3.87 110.796 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.799 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.5 m-20 -59.91 -39.46 85.51 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.419 -0.801 . . . . 1.35 110.171 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.1 mmt-85 -59.93 -50.72 72.66 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.502 -0.749 . . . . 2.93 110.342 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.873 ' HA ' HD13 ' A' ' 39' ' ' LEU . 35.5 m -67.79 -40.04 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 C-N-CA 119.48 -0.888 . . . . 1.07 109.348 178.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.96 -36.79 77.86 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.571 -0.706 . . . . 0.42 110.278 178.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 7' ' ' ASN . 40.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 121.486 -0.759 . . . . 0.95 111.305 -178.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.524 ' CD ' HD11 ' A' ' 39' ' ' LEU . 2.8 mp0 -60.0 -52.62 64.62 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.045 -1.034 . . . . 1.84 110.055 -179.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.551 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -42.11 -54.85 4.4 Favored Glycine 0 N--CA 1.508 3.485 0 N-CA-C 110.178 -1.169 . . . . 0.36 110.178 -178.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -65.61 -38.3 89.05 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.837 -0.802 . . . . 1.12 111.72 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 11' ' ' VAL . 54.5 t -59.68 -40.01 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.219 -0.925 . . . . 0.46 109.233 -178.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 61.3 t -60.0 -49.99 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.398 -0.814 . . . . 0.7 109.368 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -60.0 -43.36 95.23 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.441 -0.787 . . . . 3.15 109.761 179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -60.34 -47.61 85.28 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.756 -0.59 . . . . 2.23 110.772 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.96 -44.04 94.67 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.61 -0.682 . . . . 1.02 110.591 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.677 ' HD3' HG21 ' A' ' 29' ' ' VAL . 38.3 tptt -65.69 -40.3 92.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.521 -0.737 . . . . 2.08 109.146 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.78 -26.54 68.68 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.499 -0.926 . . . . 0.81 108.499 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 23' ' ' LYS . 45.6 mtpt -87.74 12.01 13.9 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.754 -0.591 . . . . 2.11 110.644 179.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 47.8 mtmt 59.8 20.8 9.64 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.383 -0.823 . . . . 2.28 111.195 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.87 161.78 6.18 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.461 -0.774 . . . . 0.71 109.663 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.22 162.1 43.55 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 O-C-N 123.379 1.2 . . . . 0.93 110.333 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -55.64 -27.35 49.28 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.589 -0.694 . . . . 2.0 110.028 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.9 tp10 -59.97 -39.95 87.39 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.73 -0.607 . . . . 2.22 110.294 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -70.53 -43.12 70.24 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.205 -0.934 . . . . 1.46 110.676 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.677 HG21 ' HD3' ' A' ' 20' ' ' LYS . 61.4 t -69.36 -51.96 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.485 -0.759 . . . . 0.65 110.047 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' HG12 ' A' ' 33' ' ' VAL . 61.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.709 -0.619 . . . . 1.33 110.879 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.81 -47.48 83.26 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.382 -0.824 . . . . 0.46 110.399 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.35 -43.95 84.62 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 120.09 -0.644 . . . . 0.39 110.279 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -64.66 -35.93 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.304 -0.998 . . . . 0.57 108.304 179.344 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -60.08 -42.86 95.49 Favored 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.318 -0.993 . . . . 2.82 108.318 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -60.58 -40.0 90.1 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.326 -0.99 . . . . 1.73 108.326 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.696 HD23 HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -54.85 -44.29 73.84 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.804 -0.634 . . . . 1.53 110.54 179.565 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 83.0 mt -60.0 -39.99 87.67 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.444 -0.785 . . . . 1.36 109.699 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.0 t -59.87 -32.68 70.94 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.297 -0.631 . . . . 1.31 109.297 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.873 HD13 ' HA ' ' A' ' 9' ' ' VAL . 78.8 mt -65.52 -57.97 6.92 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 120.077 -0.649 . . . . 0.72 109.416 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -60.02 -33.44 72.0 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.421 -0.799 . . . . 2.38 109.607 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.48 -42.24 91.61 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 120.267 -0.573 . . . . 0.69 109.672 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.02 -48.14 82.95 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 107.98 -1.119 . . . . 1.9 107.98 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -60.29 -39.05 85.54 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 121.723 0.773 . . . . 2.03 109.417 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -60.01 -33.08 71.51 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.831 -0.543 . . . . 2.12 111.065 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -55.46 -39.97 71.03 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.463 -0.773 . . . . 2.41 110.14 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.83 -74.93 0.1 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.506 -0.746 . . . . 2.31 109.868 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.3 t -160.05 30.17 0.18 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.473 -0.767 . . . . 2.51 110.241 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.18 68.4 1.65 Allowed Glycine 0 N--CA 1.495 2.626 0 N-CA-C 109.517 -1.433 . . . . 1.86 109.517 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -88.41 -26.85 21.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.586 -0.949 . . . . 2.7 111.428 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 11.2 pt-20 31.23 97.56 0.0 OUTLIER 'General case' 0 N--CA 1.519 3.003 0 N-CA-C 112.772 0.656 . . . . 2.37 112.772 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.46 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 46.7 p90 -54.65 139.22 39.41 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.103 -0.998 . . . . 2.77 111.52 -178.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -63.76 169.64 4.05 Favored Pre-proline 0 N--CA 1.498 1.939 0 N-CA-C 109.521 -0.548 . . . . 5.01 109.521 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -64.3 -34.48 55.36 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 122.994 0.997 . . . . 3.45 110.299 -179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.89 -1.27 87.12 Favored Glycine 0 N--CA 1.492 2.432 0 C-N-CA 119.523 -1.322 . . . . 3.07 110.574 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.0 p30 39.93 50.5 3.39 Favored Pre-proline 0 N--CA 1.507 2.404 0 CA-C-N 117.994 0.897 . . . . 4.09 112.474 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' O ' ' CE2' ' A' ' 6' ' ' TYR . 39.6 Cg_endo -69.98 149.98 66.26 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.087 1.046 . . . . 4.1 110.573 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 N--CA 1.489 1.218 0 O-C-N 123.469 1.247 . . . . 4.82 110.805 179.92 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 121.029 0.442 . . . . 3.98 110.278 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.4 p -65.39 -36.98 85.61 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.584 -0.697 . . . . 1.95 110.303 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.2 tp -60.04 -40.22 88.62 Favored 'General case' 0 N--CA 1.501 2.091 0 CA-C-O 121.68 0.752 . . . . 1.69 109.467 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.2 t -56.18 -44.47 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.984 -0.448 . . . . 1.52 109.945 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.02 -44.93 94.28 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.431 -0.793 . . . . 1.92 109.496 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -60.06 -41.65 92.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.743 -0.598 . . . . 3.87 111.27 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.691 ' O ' HG23 ' A' ' 11' ' ' VAL . 26.9 m120 -60.04 -40.63 90.07 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.472 -0.768 . . . . 1.35 111.213 -178.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.4 mtp180 -60.03 -50.37 73.99 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.383 -0.823 . . . . 2.93 110.503 -179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.782 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.1 m -69.67 -40.03 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.754 -0.832 . . . . 1.07 108.754 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.98 -38.46 82.62 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.708 -0.62 . . . . 0.42 110.554 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.691 HG23 ' O ' ' A' ' 7' ' ' ASN . 30.6 t -60.0 -49.95 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.553 -0.717 . . . . 0.95 110.46 -179.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -60.67 -53.58 55.76 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.259 -0.9 . . . . 1.84 109.738 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.735 ' HA2' HD11 ' A' ' 36' ' ' LEU . . . -39.32 -55.5 2.48 Favored Glycine 0 N--CA 1.51 3.567 0 N-CA-C 110.632 -0.987 . . . . 0.36 110.632 -178.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -61.95 -38.52 88.8 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.92 -0.753 . . . . 1.12 111.388 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' ' 11' ' ' VAL . 99.4 t -59.94 -41.96 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.319 -0.863 . . . . 0.46 109.51 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.9 t -60.7 -47.65 92.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.558 -0.714 . . . . 0.7 109.378 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -59.99 -41.14 91.42 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.56 -0.713 . . . . 3.15 110.502 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.95 -40.99 97.69 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.515 -0.74 . . . . 2.23 111.201 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.4 mt -59.99 -43.88 94.88 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.347 -0.845 . . . . 1.02 110.656 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.746 ' CD ' HG21 ' A' ' 29' ' ' VAL . 17.2 tptt -65.15 -39.98 93.72 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.713 -0.847 . . . . 2.08 108.713 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.95 -24.19 66.84 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 108.71 -0.848 . . . . 0.81 108.71 177.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -88.13 10.52 19.04 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 2.11 110.423 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt 60.08 19.92 9.14 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.375 -0.828 . . . . 2.28 111.396 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.92 163.42 9.84 Favored Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.562 -0.711 . . . . 0.71 109.968 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -73.2 160.49 45.16 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.321 1.169 . . . . 0.93 110.392 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -56.91 -29.49 63.08 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.623 -0.673 . . . . 2.0 111.002 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -56.93 -40.01 75.57 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.36 -0.838 . . . . 2.22 110.688 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -70.51 -43.37 69.78 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.417 -0.802 . . . . 1.46 110.576 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.746 HG21 ' CD ' ' A' ' 20' ' ' LYS . 77.7 t -68.41 -47.8 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.637 -0.664 . . . . 0.65 110.648 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -59.97 -44.05 94.68 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.391 -0.818 . . . . 1.33 110.349 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.4 76.2 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.556 -0.715 . . . . 0.46 110.138 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.05 -43.2 96.23 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.666 -0.647 . . . . 0.39 110.624 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.1 -35.29 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 108.492 -0.929 . . . . 0.57 108.492 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -60.02 -40.04 87.95 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.442 -1.318 . . . . 2.82 107.442 178.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -60.25 -39.96 88.62 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.209 -1.034 . . . . 1.73 108.209 177.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.735 HD11 ' HA2' ' A' ' 13' ' ' GLY . 0.6 OUTLIER -56.98 -45.03 83.24 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 116.033 -0.53 . . . . 1.53 110.173 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -56.97 -38.34 72.84 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.528 -0.732 . . . . 1.36 109.871 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -61.38 -40.03 92.85 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 109.151 -0.685 . . . . 1.31 109.151 178.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.782 ' HB3' HG12 ' A' ' 9' ' ' VAL . 55.7 mt -65.99 -55.16 18.15 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.619 -0.882 . . . . 0.72 108.619 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -60.0 -36.49 77.31 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-O 121.363 0.602 . . . . 2.38 109.651 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.72 94.79 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.822 -0.549 . . . . 0.69 110.213 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 -59.97 -48.0 83.49 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.269 -0.894 . . . . 1.9 109.142 178.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.6 -39.96 90.07 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.623 0.725 . . . . 2.03 109.217 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.424 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 88.6 tttt -60.05 -38.33 82.5 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.707 -0.62 . . . . 2.12 110.958 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.29 -39.96 80.67 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.546 -0.721 . . . . 2.41 112.11 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 44.0 mttt -61.08 -53.51 56.22 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.031 -1.043 . . . . 2.31 110.654 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.498 ' O ' HG22 ' A' ' 47' ' ' THR . 22.3 m -156.76 13.91 0.28 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.487 -0.758 . . . . 2.51 112.021 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.424 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 70.02 39.41 74.0 Favored Glycine 0 N--CA 1.498 2.814 0 N-CA-C 110.201 -1.16 . . . . 1.86 110.201 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.535 ' O ' ' O ' ' A' ' 50' ' ' GLU . 45.4 mt-30 -85.59 -20.13 29.99 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.365 -1.079 . . . . 2.7 111.483 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.535 ' O ' ' O ' ' A' ' 49' ' ' GLN . 15.5 pt-20 42.09 161.92 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 CA-C-O 122.704 1.24 . . . . 2.37 113.853 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -70.14 117.46 11.73 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.872 -1.142 . . . . 2.77 110.711 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.5 mtpp -70.57 149.1 95.46 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.559 -0.713 . . . . 5.01 109.902 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.52 -166.33 0.33 Allowed 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.327 1.172 . . . . 3.45 111.025 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 70.92 18.76 76.47 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.763 -0.935 . . . . 3.07 110.763 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 53.99 175.04 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.178 0 O-C-N 121.254 -1.145 . . . . 4.09 110.822 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.04 150.04 65.97 Favored 'Trans proline' 0 C--N 1.319 -1.008 0 O-C-N 123.093 1.049 . . . . 4.1 110.214 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo . . . . . 0 C--N 1.317 -1.124 0 O-C-N 123.462 1.243 . . . . 4.82 110.614 -179.639 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.505 ' O ' HG12 ' A' ' 4' ' ' VAL . 12.5 p-10 . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 120.875 0.369 . . . . 3.98 110.622 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.7 m -70.0 -14.52 62.73 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.414 -0.804 . . . . 1.95 111.194 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.527 HD23 ' C ' ' A' ' 3' ' ' LEU . 7.0 tt -61.33 -42.62 98.97 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.207 -0.933 . . . . 1.69 110.685 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.629 HG13 HD22 ' A' ' 5' ' ' LEU . 6.3 p -58.83 -39.4 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.677 -0.639 . . . . 1.52 110.379 -179.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.629 HD22 HG13 ' A' ' 4' ' ' VAL . 3.9 mm? -58.97 -46.2 88.68 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.733 -0.605 . . . . 1.92 110.426 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.443 ' O ' HG22 ' A' ' 9' ' ' VAL . 44.0 m-85 -60.0 -40.05 87.87 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.566 -0.709 . . . . 3.87 110.627 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.837 ' O ' HG23 ' A' ' 11' ' ' VAL . 99.5 m-20 -60.22 -40.1 88.96 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.255 -0.903 . . . . 1.35 110.553 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -60.05 -49.98 75.53 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.452 -0.78 . . . . 2.93 111.083 -179.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.862 HG12 ' HB3' ' A' ' 39' ' ' LEU . 32.6 m -67.6 -39.95 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 119.383 -0.927 . . . . 1.07 108.913 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.407 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -61.89 -38.14 87.2 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.708 -0.62 . . . . 0.42 111.276 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.837 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.5 t -59.99 -50.02 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.416 -0.803 . . . . 0.95 110.465 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.406 ' HB3' ' HB2' ' A' ' 36' ' ' LEU . 97.8 mm-40 -60.28 -50.05 75.17 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 119.101 -1.04 . . . . 1.84 109.081 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.415 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -41.48 -56.24 3.55 Favored Glycine 0 N--CA 1.509 3.545 0 N-CA-C 110.282 -1.127 . . . . 0.36 110.282 -179.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -61.6 -40.04 93.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.866 -0.785 . . . . 1.12 110.316 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.653 HG23 ' O ' ' A' ' 11' ' ' VAL . 91.9 t -59.7 -39.26 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.427 -0.796 . . . . 0.46 109.307 -179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.9 t -59.92 -50.06 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 N-CA-C 108.593 -0.891 . . . . 0.7 108.593 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.1 ttt85 -60.27 -41.42 93.23 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.742 -0.599 . . . . 3.15 110.178 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.6 -39.94 90.01 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.573 -0.705 . . . . 2.23 110.573 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.557 HD23 ' HD3' ' A' ' 22' ' ' LYS . 86.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.532 -0.73 . . . . 1.02 110.104 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HD3' HG21 ' A' ' 29' ' ' VAL . 10.5 mmtp -69.1 -40.05 78.6 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 121.574 0.702 . . . . 2.08 109.24 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.08 -33.56 72.24 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.105 -0.702 . . . . 0.81 109.105 179.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.557 ' HD3' HD23 ' A' ' 19' ' ' LEU . 14.2 ptmt -91.39 17.57 8.31 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.701 -0.8 . . . . 2.11 110.946 179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt 59.59 22.38 11.04 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.359 -0.838 . . . . 2.28 111.329 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.91 151.55 23.86 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.44 -0.788 . . . . 0.71 110.26 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -69.09 170.71 15.15 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.411 1.216 . . . . 0.93 111.032 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -57.9 -32.63 67.91 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 121.195 0.521 . . . . 2.0 110.5 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -59.23 -39.97 84.41 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.6 -0.688 . . . . 2.22 111.169 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.521 ' HB3' HD22 ' A' ' 19' ' ' LEU . 80.0 m-20 -70.16 -40.57 74.66 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.414 -0.804 . . . . 1.46 110.639 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.506 HG21 ' HD3' ' A' ' 20' ' ' LYS . 83.6 t -68.57 -52.17 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.653 -0.654 . . . . 0.65 110.438 -179.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.458 ' O ' HG12 ' A' ' 33' ' ' VAL . 79.0 m-20 -60.07 -43.85 95.16 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.59 -0.694 . . . . 1.33 110.716 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.03 -47.49 86.18 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.448 -0.782 . . . . 0.46 110.377 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.54 -44.75 89.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.599 -0.688 . . . . 0.39 110.365 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.458 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -66.52 -38.21 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 108.143 -1.058 . . . . 0.57 108.143 178.852 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -60.0 -42.04 93.39 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 108.126 -1.064 . . . . 2.82 108.126 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -62.94 -47.16 84.42 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.353 -0.981 . . . . 1.73 108.353 177.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.538 ' O ' HD12 ' A' ' 36' ' ' LEU . 2.5 tp -60.01 -41.31 91.89 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 115.831 -0.622 . . . . 1.53 109.503 178.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.19 -38.36 79.64 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.59 -0.694 . . . . 1.36 109.614 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.9 t -60.77 -41.14 94.91 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.089 -0.708 . . . . 1.31 109.089 178.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 9' ' ' VAL . 63.3 mt -63.07 -50.18 71.6 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.467 -0.938 . . . . 0.72 108.467 178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -60.02 -40.01 87.79 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 121.653 0.74 . . . . 2.38 109.341 177.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -49.31 78.17 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.867 -0.521 . . . . 0.69 110.958 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -60.01 -49.28 78.28 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.215 -0.928 . . . . 1.9 109.979 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.09 -37.01 78.68 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.572 0.701 . . . . 2.03 109.991 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.98 -40.0 87.65 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.681 -0.637 . . . . 2.12 111.297 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -57.08 -38.25 73.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.464 -0.773 . . . . 2.41 111.257 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.82 -55.17 36.2 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.267 -0.895 . . . . 2.31 110.849 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 47' ' ' THR . 29.7 m -158.45 16.85 0.21 Allowed 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.277 -0.889 . . . . 2.51 111.912 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.87 37.8 75.23 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.433 -1.467 . . . . 1.86 109.433 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' O ' ' A' ' 50' ' ' GLU . 14.3 mm100 -81.5 -29.27 33.69 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.62 -0.93 . . . . 2.7 110.795 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 49' ' ' GLN . 8.5 pt-20 40.56 -172.47 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.505 0.669 . . . . 2.37 112.543 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.401 ' CD1' HG23 ' A' ' 9' ' ' VAL . 16.0 t80 -70.34 115.42 9.51 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.169 -0.957 . . . . 2.77 110.857 -179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -71.25 146.75 92.61 Favored Pre-proline 0 N--CA 1.497 1.9 0 O-C-N 121.437 -0.789 . . . . 5.01 108.972 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -81.57 -52.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.161 1.085 . . . . 3.45 111.567 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.96 3.36 65.32 Favored Glycine 0 N--CA 1.492 2.387 0 C-N-CA 119.657 -1.259 . . . . 3.07 111.395 179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.475 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 13.8 m120 51.81 99.31 0.04 OUTLIER Pre-proline 0 N--CA 1.503 2.207 0 CA-C-N 118.724 1.262 . . . . 4.09 111.292 179.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.503 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 29.5 Cg_endo -59.97 -31.74 94.04 Favored 'Trans proline' 0 CA--C 1.553 1.445 0 O-C-N 123.115 1.061 . . . . 4.1 113.922 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 56' ' ' PRO . 47.3 Cg_endo . . . . . 0 N--CA 1.488 1.183 0 CA-C-N 119.83 0.975 . . . . 4.82 110.339 178.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 8.7 t0 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.186 0.517 . . . . 3.98 110.337 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.7 p -65.69 -39.76 91.61 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.306 -0.871 . . . . 1.95 110.768 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.1 tp -64.79 -55.13 21.59 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.545 -0.722 . . . . 1.69 111.57 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 5' ' ' LEU . 10.5 p -59.02 -41.96 84.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.549 -0.719 . . . . 1.52 110.861 -178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.45 ' N ' HG13 ' A' ' 4' ' ' VAL . 2.6 mm? -59.97 -40.6 89.61 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.598 -0.689 . . . . 1.92 109.936 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.458 ' CD1' ' HB2' ' A' ' 52' ' ' LYS . 64.9 t80 -60.02 -40.0 87.8 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.479 -0.763 . . . . 3.87 109.883 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.655 ' O ' HG23 ' A' ' 11' ' ' VAL . 74.5 m-20 -59.97 -40.0 87.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.476 -0.765 . . . . 1.35 109.804 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -60.03 -50.43 73.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.585 -0.697 . . . . 2.93 111.269 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.675 HG12 ' HB3' ' A' ' 39' ' ' LEU . 33.0 m -70.02 -40.9 79.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.225 -0.922 . . . . 1.07 109.575 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.423 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -61.13 -44.69 96.94 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.612 -0.68 . . . . 0.42 111.227 179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 7' ' ' ASN . 56.3 t -60.06 -46.7 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.384 -0.823 . . . . 0.95 110.362 -178.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -60.03 -49.13 78.88 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.118 -0.989 . . . . 1.84 109.347 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.474 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -39.47 -48.87 3.02 Favored Glycine 0 N--CA 1.51 3.631 0 N-CA-C 110.18 -1.168 . . . . 0.36 110.18 -179.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -65.38 -34.38 78.18 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.879 -0.777 . . . . 1.12 110.873 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.71 -43.66 91.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 O-C-N 121.284 -0.885 . . . . 0.46 109.264 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.569 HG13 HG13 ' A' ' 29' ' ' VAL . 55.9 t -60.47 -45.51 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 N-CA-C 107.911 -1.144 . . . . 0.7 107.911 177.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 76.7 mtp85 -60.32 -40.02 89.11 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 116.04 -0.527 . . . . 3.15 110.879 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.97 -42.5 94.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.48 -0.763 . . . . 2.23 109.93 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 22' ' ' LYS . 89.1 mt -60.4 -40.18 90.0 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.493 0.663 . . . . 1.02 110.612 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.689 ' HE2' HG11 ' A' ' 29' ' ' VAL . 20.7 mmtt -68.67 -39.99 80.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.392 -0.818 . . . . 2.08 109.052 179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -30.86 69.4 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.073 -0.714 . . . . 0.81 109.073 178.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.448 ' HG2' ' HA ' ' A' ' 19' ' ' LEU . 17.7 ptpt -94.31 19.33 9.62 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.771 -0.771 . . . . 2.11 110.773 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? 56.9 24.47 9.36 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.423 -0.798 . . . . 2.28 111.082 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.86 59.62 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.66 -0.65 . . . . 0.71 110.369 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.71 159.38 51.44 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.473 1.249 . . . . 0.93 110.684 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -55.17 -27.53 46.34 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.672 -0.642 . . . . 2.0 109.611 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.2 tp10 -59.32 -40.12 85.26 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.787 -0.571 . . . . 2.22 110.047 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' 19' ' ' LEU . 74.3 m-20 -70.73 -45.52 64.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.535 -0.728 . . . . 1.46 110.006 179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.689 HG11 ' HE2' ' A' ' 20' ' ' LYS . 66.9 t -67.31 -40.49 84.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.737 -0.602 . . . . 0.65 109.801 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.425 ' O ' HG12 ' A' ' 33' ' ' VAL . 77.9 m-20 -60.07 -49.01 79.34 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.596 -0.69 . . . . 1.33 110.943 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.19 91.14 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.191 -0.943 . . . . 0.46 110.562 -179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.53 -41.27 89.02 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.674 -0.641 . . . . 0.39 110.837 -179.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.499 ' O ' HD23 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -66.25 -39.49 84.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.239 -0.913 . . . . 0.57 108.646 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -60.2 -40.88 91.62 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.173 -1.047 . . . . 2.82 108.173 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -65.72 -44.68 85.3 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.126 -1.064 . . . . 1.73 108.126 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 39' ' ' LEU . 14.4 tp -59.06 -48.86 80.07 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 115.54 -0.754 . . . . 1.53 110.176 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.544 HD13 ' HD2' ' A' ' 40' ' ' LYS . 4.1 mm? -58.4 -37.46 75.36 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.318 -0.864 . . . . 1.36 109.657 179.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.4 t -59.97 -36.76 77.83 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.545 -0.722 . . . . 1.31 109.339 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.675 ' HB3' HG12 ' A' ' 9' ' ' VAL . 94.0 mt -59.95 -41.49 91.99 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.505 -0.747 . . . . 0.72 109.283 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.544 ' HD2' HD13 ' A' ' 37' ' ' LEU . 98.3 mttt -62.7 -40.44 97.13 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 120.149 -0.62 . . . . 2.38 109.511 179.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.02 -40.61 89.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.79 -0.569 . . . . 0.69 110.498 -179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -60.15 -48.7 80.64 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.517 -0.739 . . . . 1.9 109.639 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -60.04 -40.44 89.39 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.618 -0.676 . . . . 2.03 110.031 179.142 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.435 ' HA ' ' HA2' ' A' ' 48' ' ' GLY . 97.9 mttt -62.71 -23.85 67.36 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.725 -0.609 . . . . 2.12 111.979 -179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.07 -39.97 79.87 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.272 -0.893 . . . . 2.41 111.014 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.611 ' O ' HG23 ' A' ' 47' ' ' THR . 42.1 mmtm -64.26 -56.14 16.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.538 -0.726 . . . . 2.31 110.657 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 46' ' ' LYS . 0.2 OUTLIER -163.21 27.28 0.09 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.461 -0.774 . . . . 2.51 110.804 -179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.435 ' HA2' ' HA ' ' A' ' 44' ' ' LYS . . . 71.62 41.1 57.92 Favored Glycine 0 N--CA 1.497 2.737 0 C-N-CA 120.012 -1.09 . . . . 1.86 110.387 -179.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HB2' ' CD1' ' A' ' 43' ' ' TYR . 70.7 mt-30 -83.45 -23.01 32.44 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.31 -1.112 . . . . 2.7 110.897 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 36.7 -157.55 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 112.602 0.593 . . . . 2.37 112.602 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.41 ' HH ' ' HH ' ' A' ' 6' ' ' TYR . 64.8 t80 -64.66 123.66 19.89 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.364 -0.835 . . . . 2.77 110.46 -179.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.458 ' HB2' ' CD1' ' A' ' 6' ' ' TYR . 51.6 mmtt -68.51 136.81 90.78 Favored Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.529 -0.732 . . . . 5.01 109.424 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 52' ' ' LYS . 51.9 Cg_endo -88.96 176.65 3.2 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.167 1.088 . . . . 3.45 111.38 -179.074 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 70.37 28.86 70.68 Favored Glycine 0 N--CA 1.493 2.498 0 N-CA-C 111.08 -0.808 . . . . 3.07 111.08 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 54.66 178.49 0.03 OUTLIER Pre-proline 0 N--CA 1.506 2.346 0 O-C-N 121.039 -1.271 . . . . 4.09 110.113 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -70.01 149.98 66.02 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.046 1.024 . . . . 4.1 109.902 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo . . . . . 0 C--N 1.317 -1.095 0 O-C-N 123.334 1.176 . . . . 4.82 110.699 -179.418 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.25 0.548 . . . . 3.98 110.586 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 97.2 p -66.72 -25.28 66.45 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.669 -0.644 . . . . 1.95 110.597 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.532 HD23 ' C ' ' A' ' 3' ' ' LEU . 10.5 tt -60.82 -43.69 97.88 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.406 -0.809 . . . . 1.69 110.005 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 70.0 t -58.8 -49.29 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.864 -0.523 . . . . 1.52 110.062 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.99 -39.99 87.62 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.648 -0.658 . . . . 1.92 110.625 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -58.68 -40.98 85.14 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.44 -0.787 . . . . 3.87 110.59 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.3 m120 -60.44 -40.38 90.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.612 -0.68 . . . . 1.35 111.421 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -59.97 -53.05 62.42 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.284 -0.885 . . . . 2.93 110.738 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.863 HG12 ' HB3' ' A' ' 39' ' ' LEU . 28.8 m -69.87 -40.06 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.587 -0.696 . . . . 1.07 109.763 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.472 ' HB1' ' CG ' ' A' ' 55' ' ' ASN . . . -60.15 -43.58 95.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.757 -0.589 . . . . 0.42 111.464 179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.698 HG23 ' O ' ' A' ' 7' ' ' ASN . 54.4 t -59.96 -49.23 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.422 -0.799 . . . . 0.95 110.406 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -59.98 -50.14 74.92 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.023 -1.048 . . . . 1.84 109.47 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.648 ' HA2' HD22 ' A' ' 36' ' ' LEU . . . -38.77 -49.47 2.51 Favored Glycine 0 N--CA 1.509 3.521 0 N-CA-C 110.654 -0.978 . . . . 0.36 110.654 -178.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -64.53 -37.6 88.12 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.868 -0.783 . . . . 1.12 110.979 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.94 -40.06 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.407 -0.808 . . . . 0.46 109.815 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.472 HG22 ' CB ' ' A' ' 32' ' ' ALA . 83.1 t -59.92 -50.34 80.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.938 . . . . 0.7 108.826 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -62.53 -40.01 95.41 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-O 121.553 0.692 . . . . 3.15 109.783 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.0 tp10 -59.95 -42.44 94.04 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.863 -0.523 . . . . 2.23 111.341 -178.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.727 HD13 ' HB3' ' A' ' 28' ' ' ASP . 89.8 mt -59.95 -44.88 94.12 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.777 0.799 . . . . 1.02 109.928 -179.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.749 ' HD2' HG13 ' A' ' 29' ' ' VAL . 17.3 mtpt -69.97 -37.49 75.81 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.497 -0.927 . . . . 2.08 108.497 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.48 70.9 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.708 -0.849 . . . . 0.81 108.708 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.541 ' HE2' HD23 ' A' ' 19' ' ' LEU . 43.8 pttt -93.91 20.93 7.14 Favored 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 119.552 -0.859 . . . . 2.11 110.611 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt 60.05 20.38 9.54 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.532 -0.73 . . . . 2.28 111.926 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.521 ' HB2' ' CE ' ' A' ' 22' ' ' LYS . . . -58.19 163.06 4.91 Favored Pre-proline 0 N--CA 1.501 2.081 0 O-C-N 121.424 -0.798 . . . . 0.71 110.614 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -76.77 166.52 26.89 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 O-C-N 123.449 1.236 . . . . 0.93 111.128 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -58.21 -28.27 64.67 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.736 -0.603 . . . . 2.0 111.316 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -57.67 -40.07 78.54 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.143 -0.973 . . . . 2.22 110.423 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.727 ' HB3' HD13 ' A' ' 19' ' ' LEU . 10.3 m-20 -71.84 -39.98 69.36 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.68 0.752 . . . . 1.46 109.52 178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.749 HG13 ' HD2' ' A' ' 20' ' ' LYS . 61.1 t -66.95 -53.36 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 CA-C-N 116.224 -0.444 . . . . 0.65 110.439 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.443 ' O ' HG12 ' A' ' 33' ' ' VAL . 86.7 m-20 -59.95 -48.0 83.5 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.567 -0.708 . . . . 1.33 111.269 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.98 83.64 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.298 -0.877 . . . . 0.46 110.519 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.472 ' CB ' HG22 ' A' ' 16' ' ' VAL . . . -66.43 -40.01 89.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.647 -0.658 . . . . 0.39 110.554 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -66.99 -40.04 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 119.489 -0.884 . . . . 0.57 108.73 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.15 -40.29 93.3 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.046 -1.062 . . . . 2.82 108.364 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -66.12 -47.16 75.06 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.806 -0.812 . . . . 1.73 108.806 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.648 HD22 ' HA2' ' A' ' 13' ' ' GLY . 3.6 tp -60.06 -43.73 95.22 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.95 -0.469 . . . . 1.53 110.062 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.1 mt -59.98 -39.13 84.61 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.489 -0.757 . . . . 1.36 109.714 179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.6 m -60.0 -39.53 86.09 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 109.271 -0.641 . . . . 1.31 109.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.863 ' HB3' HG12 ' A' ' 9' ' ' VAL . 81.9 mt -60.21 -55.45 33.58 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.435 -0.79 . . . . 0.72 109.91 179.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.555 ' HE3' HD11 ' A' ' 36' ' ' LEU . 98.4 mttt -60.91 -38.56 86.15 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.482 -0.762 . . . . 2.38 109.65 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.06 -45.2 93.65 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 120.433 -0.507 . . . . 0.69 110.592 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -60.13 -50.95 71.66 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.124 -0.985 . . . . 1.9 109.792 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -63.54 -39.2 93.8 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.749 0.785 . . . . 2.03 109.801 178.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -60.01 -39.29 85.32 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.872 -0.518 . . . . 2.12 111.013 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -55.44 -37.77 68.15 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.422 -0.799 . . . . 2.41 111.023 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -63.07 -56.4 17.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.253 -0.905 . . . . 2.31 111.322 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.598 HG22 ' O ' ' A' ' 47' ' ' THR . 34.5 m -157.14 18.14 0.29 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.295 -0.878 . . . . 2.51 111.848 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 67.76 52.25 30.53 Favored Glycine 0 N--CA 1.496 2.655 0 N-CA-C 108.679 -1.769 . . . . 1.86 108.679 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.468 ' HB2' ' CD2' ' A' ' 43' ' ' TYR . 90.3 mm-40 -76.63 -37.64 56.01 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.69 -0.888 . . . . 2.7 111.472 -178.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 32.7 96.83 0.0 OUTLIER 'General case' 0 N--CA 1.518 2.963 0 N-CA-C 112.711 0.634 . . . . 2.37 112.711 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.461 ' CE1' ' HB ' ' A' ' 9' ' ' VAL . 41.0 p90 -55.66 143.97 28.5 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.911 -1.118 . . . . 2.77 110.467 -179.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.61 157.65 77.84 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.665 -0.647 . . . . 5.01 110.967 -178.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -70.49 -7.18 20.67 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.586 1.309 . . . . 3.45 111.46 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.99 1.96 77.27 Favored Glycine 0 N--CA 1.496 2.7 0 C-N-CA 119.82 -1.181 . . . . 3.07 111.405 178.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.472 ' CG ' ' HB1' ' A' ' 10' ' ' ALA . 0.4 OUTLIER 55.8 174.72 0.04 OUTLIER Pre-proline 0 N--CA 1.504 2.251 0 O-C-N 120.984 -1.303 . . . . 4.09 110.801 179.708 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -70.02 150.04 66.09 Favored 'Trans proline' 0 N--CA 1.487 1.116 0 O-C-N 123.522 1.275 . . . . 4.1 110.567 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.487 1.105 0 O-C-N 123.464 1.244 . . . . 4.82 110.682 -179.583 . . . . . . . . 0 0 . 1 stop_ save_